SDF/Mol File of Acetamide, N-[5-(aminosulfonyl)-1,3,4-thiadiazol-2-yl]-2-chloro- (C4H5ClN4O3S2)

Structure Data File (SDF/MOL File) Description

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Additional Information for Identifying Acetamide, N-[5-(aminosulfonyl)-1,3,4-thiadiazol-2-yl]-2-chloro- Molecule

• Chemical structure of Acetamide, N-[5-(aminosulfonyl)-1,3,4-thiadiazol-2-yl]-2-chloro-

  By visualizing the structure data file (SDF/MOL File) above, the chemical structure image of Acetamide, N-[5-(aminosulfonyl)-1,3,4-thiadiazol-2-yl]-2-chloro- is available in chemical structure page of Acetamide, N-[5-(aminosulfonyl)-1,3,4-thiadiazol-2-yl]-2-chloro-, which specifies the molecular geometry, i.e., the spatial arrangement of atoms and the chemical bonds that hold the atoms together.

• Molecular weight of Acetamide, N-[5-(aminosulfonyl)-1,3,4-thiadiazol-2-yl]-2-chloro-

  The molecular weight of Acetamide, N-[5-(aminosulfonyl)-1,3,4-thiadiazol-2-yl]-2-chloro- is available in molecular weight page of Acetamide, N-[5-(aminosulfonyl)-1,3,4-thiadiazol-2-yl]-2-chloro-, which is calculated as the sum of the atomic masses of each constituent element multiplied by the number of atoms of that element.

• Chemical formula of Acetamide, N-[5-(aminosulfonyl)-1,3,4-thiadiazol-2-yl]-2-chloro-

  The chemical formula of Acetamide, N-[5-(aminosulfonyl)-1,3,4-thiadiazol-2-yl]-2-chloro- is given in chemical formula page of Acetamide, N-[5-(aminosulfonyl)-1,3,4-thiadiazol-2-yl]-2-chloro-, which identifies each constituent element by its chemical symbol and indicates the proportionate number of atoms of each element.

• InChI (IUPAC International Chemical Identifier) information of Acetamide, N-[5-(aminosulfonyl)-1,3,4-thiadiazol-2-yl]-2-chloro-

  An alternative way of expressing structural information in text format is InChI. The full standard InChI of Acetamide, N-[5-(aminosulfonyl)-1,3,4-thiadiazol-2-yl]-2-chloro- is:

  InChI=1S/C4H5ClN4O3S2/c5-1-2(10)7-3-8-9-4(13-3)14(6,11)12/h1H2,(H2,6,11,12)(H,7,8,10)

  It can provide a standard way to encode the molecular information of Acetamide, N-[5-(aminosulfonyl)-1,3,4-thiadiazol-2-yl]-2-chloro- 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 Acetamide, N-[5-(aminosulfonyl)-1,3,4-thiadiazol-2-yl]-2-chloro- is:

  InChIKey=BLOQKEKPXLBTBC-UHFFFAOYSA-N

  The InChIKey may allow easier web searches for Acetamide, N-[5-(aminosulfonyl)-1,3,4-thiadiazol-2-yl]-2-chloro-, but it needs to be linked to the full InChI to get back to the original structure of the Acetamide, N-[5-(aminosulfonyl)-1,3,4-thiadiazol-2-yl]-2-chloro- since the full standard InChI cannot be reconstructed from the InChIKey.

• Other names (synonyms) or registry numbers of Acetamide, N-[5-(aminosulfonyl)-1,3,4-thiadiazol-2-yl]-2-chloro-

  The Acetamide, N-[5-(aminosulfonyl)-1,3,4-thiadiazol-2-yl]-2-chloro- compound may be named differently depending on the various situations of industrial applications. Other names (synonyms) of Acetamide, N-[5-(aminosulfonyl)-1,3,4-thiadiazol-2-yl]-2-chloro- including the registry numbers are listed below, if available:

  • 14949-02-1
  • Acetamide, N-[5-(aminosulfonyl)-1,3,4-thiadiazol-2-yl]-2-chloro-

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Acetamide, N-[5-(aminosulfonyl)-1,3,4-thiadiazol-2-yl]-2-chloro- Identification Summary Frequently Asked Questions (FAQs)

What’s the Acetamide, N-[5-(aminosulfonyl)-1,3,4-thiadiazol-2-yl]-2-chloro- formula?
C4H5ClN4O3S2
How many atoms and what elements are included in the Acetamide, N-[5-(aminosulfonyl)-1,3,4-thiadiazol-2-yl]-2-chloro- molecule?
19 atom(s) - 5 Hydrogen atom(s), 4 Carbon atom(s), 4 Nitrogen atom(s), 3 Oxygen atom(s), 2 Sulfur atom(s), and 1 Chlorine atom(s)
How many chemical bonds and what kind of bonds are in the Acetamide, N-[5-(aminosulfonyl)-1,3,4-thiadiazol-2-yl]-2-chloro- structure?
19 bond(s) - 14 non-H bond(s), 8 multiple bond(s), 2 rotatable bond(s), 3 double bond(s), 5 aromatic bond(s), 1 five-membered ring(s), 1 secondary amide(s) (aliphatic), and 1 sulfonamide(s) (thio-/dithio-)
What’s the Acetamide, N-[5-(aminosulfonyl)-1,3,4-thiadiazol-2-yl]-2-chloro-’s molar mass?
256.6905 g/mol
What’s the SMILES structure of Acetamide, N-[5-(aminosulfonyl)-1,3,4-thiadiazol-2-yl]-2-chloro-?
NS(=O)(=O)c1nnc(NC(=O)CCl)s1
What’s the InChI code of Acetamide, N-[5-(aminosulfonyl)-1,3,4-thiadiazol-2-yl]-2-chloro-?
InChI=1S/C4H5ClN4O3S2/c5-1-2(10)7-3-8-9-4(13-3)14(6,11)12/h1H2,(H2,6,11,12)(H,7,8,10)
What’s the InChIKey format of Acetamide, N-[5-(aminosulfonyl)-1,3,4-thiadiazol-2-yl]-2-chloro-?
BLOQKEKPXLBTBC-UHFFFAOYSA-N

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commercialized into Mol-Instincts database and ChemRTP, ChemEssen, Inc (2024).