4-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-3-nitro-benzamide

Systemtic Name: 4-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-3-nitro-benzamide Openeye Name: 4-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-3-nitro-benzamide CAS Name: 4-[[[5-(methylthio)-1,3,4-thiadiazol-2-yl]thio]methyl]-3-nitrobenzamide IUPAC Name: 4-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-3-nitrobenzamide Traditional Name: 4-[[[5-(methylthio)-1,3,4-thiadiazol-2-yl]thio]methyl]-3-nitro-benzamide Formula: C11H10N4O3S3 MolecularWeight: 342.4171

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN=C(S1)SCC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CSC1=NN=C(S1)SCC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C11H10N4O3S3/c1-19-10-13-14-11(21-10)20-5-7-3-2-6(9(12)16)4-8(7)15(17)18/h2-4H,5H2,1H3,(H2,12,16)