Structure & Deep Data of Metallibure (C7H14N4S2)

Chemical Structure Description

A chemical structure of a molecule includes the arrangement of atoms and the chemical bonds that hold the atoms together. The Metallibure molecule contains a total of 26 bond(s). There are 12 non-H bond(s), 3 multiple bond(s), 3 rotatable bond(s), 3 double bond(s), 2 urea (-thio) derivative(s), and 1 N hydrazine(s). Images of the chemical structure of Metallibure are given below:

The 2D chemical structure image of Metallibure is also called skeletal formula, which is the standard notation for organic molecules. The carbon atoms in the chemical structure of Metallibure are implied to be located at the corner(s) and hydrogen atoms attached to carbon atoms are not indicated – each carbon atom is considered to be associated with enough hydrogen atoms to provide the carbon atom with four bonds.

The 3D chemical structure image of Metallibure is based on the ball-and-stick model which displays both the three-dimensional position of the atoms and the bonds between them. The radius of the spheres is therefore smaller than the rod lengths in order to provide a clearer view of the atoms and bonds throughout the chemical structure model of Metallibure. Download structure data file (SDF/MOL) file of this compound.

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Additional Information for Identifying Metallibure Molecule

• SMILES (Simplified Molecular-Input Line-Entry System) string of Metallibure

  The SMILES string of Metallibure is CNC(=S)NNC(=S)NC(C)C=C, which can be can be imported by most molecule editors for conversion back into two-dimensional drawings or three-dimensional models of the Metallibure.

• Structure Data File (SDF/MOL File) of Metallibure

  The structure data file (SDF/MOL File) of Metallibure is available for download in the SDF page of Metallibure, which provides the information about the atoms, bonds, connectivity and coordinates of Metallibure. The Metallibure structure data file can be imported to most of the cheminformatics software systems and applications.

• Chemical formula of Metallibure

  The molecular formula of Metallibure is available in chemical formula page of Metallibure, which identifies each constituent element by its chemical symbol and indicates the proportionate number of atoms of each element.

• Molecular weight of Metallibure

  The molecular weight of Metallibure is available in molecular weight page of Metallibure, which is calculated as the sum of the atomic weights of each constituent element multiplied by the number of atoms of that element in the molecular formula.

• Other names (synonyms) or registry numbers of Metallibure

  The Metallibure compound may be called differently depending on the various different situations of industrial applications. Below are the list of the other names (synonyms) of Metallibure including the various registry numbers, if available:

  • N~1~-Methyl-N~2~-(1-methyl-2-propenyl)-1,2-hydrazinedicarbothioamide
  • 1-[(.alpha.-Methylallyl)thiocarbamoyl]-2-(methylthiocarbamoyl)hydrazine
  • {N-[(1-Methylallyl)thiocarbamoyl]-N'-(methylthiocarbamoyl)hydrazine}
  • {1-[(.Alpha.-Methylallyl)thiocarbamoyl]-2-(methylthiocarbamoyl)hydr} azine
  • 1-(BUT-3-EN-2-YL)-3-[(METHYLCARBAMOTHIOYL)AMINO]THIOUREA
  • 1, 2-Hydrazinedicarbothioamide, N-methyl-N'-(1-methyl-2-propenyl)-
  • Biurea, 2, 5-dithio-1-methyl-6-(1-methyl-2-propenyl)-
  • Biurea,5-dithio-1-methyl-6-(1-methyl-2-propenyl)-
  • 1-but-3-en-2-yl-3-(methylcarbamothioylamino)thiourea
  • Biurea, 1-methyl-6-(1-methylallyl)-2, 5-dithio-

  • 1-methyl-3-(1-methylallylcarbamothioylamino)thiourea
  • D04975
  • 42257P
  • 1, N-methyl-N'-(1-methyl-2-propenyl)-
  • ICI-33828
  • Methallibure (USAN/INN)
  • .meta.Llibure
  • N-[(1-Methylallyl)thiocarbamoyl]-N'-(methylthiocarbamoyl)hydrazine
  • Metallibur
  • Methallibure [USAN:BAN]

  • Methallibure [USAN]
  • Metalliburum
  • Metalibura
  • N-((1-Methylallyl)thiocarbamoyl)-N'-(methylthiocarbamoyl)hydrazine
  • 1,2-Hydrazinedicarbothioamide, N-methyl-N'-(1-methyl-2-propenyl)-
  • 1-alpha-Methylallylthiocarbamoyl-2-methylthiocarbamoylhydrazine
  • 1alpha-Methylallylthiocarbamoyl-2-methylthiocarbamoylhydrazine
  • Biurea, 2,5-dithio-1-methyl-6-(1-methyl-2-propenyl)-
  • BIUREA, 1-METHYL-6-(1-METHYLALLYL)-2,5-DITHIO-
  • I.C.I. 33,828

  • AY 61122
  • ICI 33,828
  • 2,5-Dithio-1-methyl-6-(1-methyl-2-propenyl)biurea
  • 926-93-2
  • ICI-33,828
  • 1-Methyl-6-(1-methylallyl)-2,5-dithiobiurea
  • Metalliburum [INN-Latin]
  • Metalibura [INN-Spanish]
  • 1-Methyl-6-(1-methylallyl)dithiobiurea
  • Almax

  • I.C.I. Compound 33828
  • Compound 33,828
  • ICI 33828
  • Metalliburum [Latin]
  • Metalibura [Spanish]
  • Match
  • Turisynchron
  • Suisynchron
  • Aimax
  • Methallibure

  • Metallibure

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Metallibure Identification Summary Frequently Asked Questions (FAQs)

What’s the chemical formula of Metallibure?
C7H14N4S2
How many atoms and what are the elements included the Metallibure molecule?
27 atom(s) - 14 Hydrogen atom(s), 7 Carbon atom(s), 4 Nitrogen atom(s), and 2 Sulfur atom(s)
How many chemical bonds and what kind of bonds are included the Metallibure structure?
26 bond(s) - 12 non-H bond(s), 3 multiple bond(s), 3 rotatable bond(s), 3 double bond(s), 2 urea (-thio) derivative(s), and 1 N hydrazine(s)
What’s the Metallibure’s molecular weight?
218.34286 g/mol
What’s the SMILES code of Metallibure?
CNC(=S)NNC(=S)NC(C)C=C
What’s the InChI string of Metallibure?
InChI=1S/C7H14N4S2/c1-4-5(2)9-7(13)11-10-6(12)8-3/h4-5H,1H2,2-3H3,(H2,8,10,12)(H2,9,11,13)
What’s the InChIKey code of Metallibure?
CGFFKDRVHZIQHL-UHFFFAOYSA-N

39 The contents of this page can freely be shared if cited as follows:
Source: Chemical Compounds Deep Data Source (CCDDS; https://www.molinstincts.com) based on 41 patented QSQN and QN technology
commercialized into Mol-Instincts database and ChemRTP, ChemEssen, Inc (2024).