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

Systemtic Name: 3-nitro-4-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]benzamide Openeye Name: 3-nitro-4-(1-phenyltetrazol-5-yl)sulfanyl-benzamide CAS Name: 3-nitro-4-[(1-phenyl-5-tetrazolyl)thio]benzamide IUPAC Name: 3-nitro-4-(1-phenyltetrazol-5-yl)sulfanylbenzamide Traditional Name: 3-nitro-4-[(1-phenyltetrazol-5-yl)thio]benzamide Formula: C14H10N6O3S MolecularWeight: 342.3326

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=N2)SC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=N2)SC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C14H10N6O3S/c15-13(21)9-6-7-12(11(8-9)20(22)23)24-14-16-17-18-19(14)10-4-2-1-3-5-10/h1-8H,(H2,15,21)