Molecular Weight of BUTAPERAZINE (C24H31N3OS)

Molecular Weight Description

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Additional Information for Identifying BUTAPERAZINE Molecule

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

  The structure data file (SDF/MOL File) of BUTAPERAZINE is available for download in the SDF page of BUTAPERAZINE, which provides the information on atoms, bonds, connectivity and coordinates of BUTAPERAZINE. The BUTAPERAZINE structure data file can be imported to most of the chemistry-related software, providing three-dimensional visualization and further analysis.

• Chemical structure of BUTAPERAZINE

  The molecular structure image of BUTAPERAZINE is available in chemical structure page of BUTAPERAZINE, which provides the molecular geometry information, i.e., the spatial arrangement of atoms in BUTAPERAZINE and the chemical bonds that hold the atoms together.

• Chemical formula of BUTAPERAZINE

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

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• InChI (IUPAC International Chemical Identifier) information of BUTAPERAZINE

  In addition to the molecular weight information, the structural information of BUTAPERAZINE in a textual expression is available via InChi. The full standard InChI of BUTAPERAZINE is given below:

  InChI=1S/C24H31N3OS/c1-3-7-22(28)19-10-11-24-21(18-19)27(20-8-4-5-9-23(20)29-24)13-6-12-26-16-14-25(2)15-17-26/h4-5,8-11,18H,3,6-7,12-17H2,1-2H3

  It can provide a way to encode the molecular information of BUTAPERAZINE to facilitate the search for the compound information in databases and on the web.

  The condensed, 27 character standard InChIKey (hashed version of the full standard InChI) of BUTAPERAZINE is:

  InChIKey=DVLBYTMYSMAKHP-UHFFFAOYSA-N

  It may allow easier web searches for BUTAPERAZINE. The InChIKey, however, needs to be linked to the full InChI as well in order to get back to the original structure of the BUTAPERAZINE as the full standard InChI cannot be reconstructed from the InChIKey.

• Other names (synonyms) or registry numbers of BUTAPERAZINE

  There may be different names of the BUTAPERAZINE compound depending on the various situations of industrial applications, which are given below including the registry numbers if available:

  • 1-(10-[3-(4-Methyl-1-piperazinyl)propyl]-10H-phenothiazin-2-yl)-1-butanone #
  • 1-[10-[3-(4-methylpiperazin-1-yl)propyl]phenothiazin-2-yl]butan-1-one
  • 3-n-Butyryl-10-(3'-N-methyl-piperazino-N'-propyl)phenothiazine
  • D02642
  • TXP4T9106S
  • BAYER-1362
  • Butaperazine (USAN)
  • 1-(10-[3-(4-Methyl-1-piperazinyl)propyl]phenothiazin-2-yl)-1-butanone
  • 1-{10-(3-(4-Methyl-1-piperazinyl)propyl)phenothiazin-2-yl}-1-butanone
  • 2-Butyryl-10-[3-(4-methyl-1-piperazinyl)propyl]phenothiazine

  • Butaperazinum
  • Butaperazina
  • 1-Butanone, 1-[10-[3-(4-methyl-1-piperazinyl)propyl]-10H-phenothiazin-2-yl]-
  • 1-Butanone, 1-(10-(3-(4-methyl-1-piperazinyl)propyl)-10H-phenothiazin-2-yl)-
  • 1-(10-(3-(4-Methyl-1-piperazinyl)-propyl)-10H-phenothiazin-2-yl)-1-butanone
  • 1- 10-(3-(4-Methyl-1-piperazinyl)propyl)phenothiazin-2-yl -1-butanone
  • N-(gamma-(4'-Methyl-1'-piperazinyl)propyl)-3-butyrylphenothiazine
  • 3-n-Butyryl-10-(3'-N-methyl-piperazino-N'-propyl)phenothiazin
  • 2-Butyryl-10-(3-(4-methyl-1-piperazinyl)propyl)phenothiazine
  • C24H31N3OS

  • 1-Butanone, 1-(10-(3-(4-methyl-1-piperazinyl)propyl)phenothiazin-2-yl)-
  • 1-(10-(3-(4-Methyl-1-piperazinyl)propyl)phenothiazin-2-yl)-1-butanone
  • AHR-3000
  • 653-03-2
  • Butaperazina [INN-Spanish]
  • Butaperazinum [INN-Latin]
  • Butaperazine [USAN:INN]
  • AHR-712
  • AHR 712
  • Tyrylen

  • Perazine, (1-oxobutyl)-
  • Perazine, butyryl-
  • Bayer 1362
  • Butyrylyperazine
  • Riker 595
  • Repoise
  • Emerex
  • Randolectil
  • Megalectil
  • Butyrylperazine

  • BUTAPERAZINE

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BUTAPERAZINE Identification Summary Frequently Asked Questions (FAQs)

What’s the formula of BUTAPERAZINE?
C24H31N3OS
How many atoms and what are the elements in the BUTAPERAZINE molecule?
60 atom(s) - 31 Hydrogen atom(s), 24 Carbon atom(s), 3 Nitrogen atom(s), 1 Oxygen atom(s), and 1 Sulfur atom(s)
How many chemical bonds and what types of bonds are in the BUTAPERAZINE structure?
63 bond(s) - 32 non-H bond(s), 13 multiple bond(s), 7 rotatable bond(s), 1 double bond(s), 12 aromatic bond(s), 4 six-membered ring(s), 2 ten-membered ring(s), 1 ketone(s) (aromatic), 2 tertiary amine(s) (aliphatic), 1 tertiary amine(s) (aromatic), and 1 sulfide(s)
What’s the molar mass of BUTAPERAZINE?
409.58744 g/mol
What’s the SMILES format of BUTAPERAZINE?
CCCC(=O)c4ccc3Sc1ccccc1N(CCCN2CCN(C)CC2)c3c4
What’s the InChI format of BUTAPERAZINE?
InChI=1S/C24H31N3OS/c1-3-7-22(28)19-10-11-24-21(18-19)27(20-8-4-5-9-23(20)29-24)13-6-12-26-16-14-25(2)15-17-26/h4-5,8-11,18H,3,6-7,12-17H2,1-2H3
What’s the InChIKey string of BUTAPERAZINE?
DVLBYTMYSMAKHP-UHFFFAOYSA-N

187 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).