N-(2-methylphenyl)-2-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-5-nitro-benzamide

Systemtic Name: N-(2-methylphenyl)-2-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-5-nitro-benzamide Openeye Name: 2-(1-methyltetrazol-5-yl)sulfanyl-5-nitro-N-(o-tolyl)benzamide CAS Name: N-(2-methylphenyl)-2-[(1-methyl-5-tetrazolyl)thio]-5-nitrobenzamide IUPAC Name: N-(2-methylphenyl)-2-(1-methyltetrazol-5-yl)sulfanyl-5-nitrobenzamide Traditional Name: 2-[(1-methyltetrazol-5-yl)thio]-5-nitro-N-(o-tolyl)benzamide Formula: C16H14N6O3S MolecularWeight: 370.38576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])SC3=NN=NN3C

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])SC3=NN=NN3C

InChI

InChI=1S/C16H14N6O3S/c1-10-5-3-4-6-13(10)17-15(23)12-9-11(22(24)25)7-8-14(12)26-16-18-19-20-21(16)2/h3-9H,1-2H3,(H,17,23)