N-[(4-cyanophenyl)carbamoyl]-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanamide

Systemtic Name: N-[(4-cyanophenyl)carbamoyl]-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanamide Openeye Name: N-[(4-cyanophenyl)carbamoyl]-2-(1-phenyltetrazol-5-yl)sulfanyl-acetamide CAS Name: N-[(4-cyanoanilino)-oxomethyl]-2-[(1-phenyl-5-tetrazolyl)thio]acetamide IUPAC Name: N-[(4-cyanophenyl)carbamoyl]-2-(1-phenyltetrazol-5-yl)sulfanylacetamide Traditional Name: N-[(4-cyanophenyl)carbamoyl]-2-[(1-phenyltetrazol-5-yl)thio]acetamide Formula: C17H13N7O2S MolecularWeight: 379.39582

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=N2)SCC(=O)NC(=O)NC3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=N2)SCC(=O)NC(=O)NC3=CC=C(C=C3)C#N

InChI

InChI=1S/C17H13N7O2S/c18-10-12-6-8-13(9-7-12)19-16(26)20-15(25)11-27-17-21-22-23-24(17)14-4-2-1-3-5-14/h1-9H,11H2,(H2,19,20,25,26)