4-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-3-oxidanylidene-N-phenyl-butanamide

Systemtic Name: 4-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-3-oxidanylidene-N-phenyl-butanamide Openeye Name: 4-(1-methyltetrazol-5-yl)sulfanyl-3-oxo-N-phenyl-butanamide CAS Name: 4-[(1-methyl-5-tetrazolyl)thio]-3-oxo-N-phenylbutanamide IUPAC Name: 4-(1-methyltetrazol-5-yl)sulfanyl-3-oxo-N-phenylbutanamide Traditional Name: 3-keto-4-[(1-methyltetrazol-5-yl)thio]-N-phenyl-butyramide Formula: C12H13N5O2S MolecularWeight: 291.32892

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=N1)SCC(=O)CC(=O)NC2=CC=CC=C2

Isomeric SMILES

CN1C(=NN=N1)SCC(=O)CC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C12H13N5O2S/c1-17-12(14-15-16-17)20-8-10(18)7-11(19)13-9-5-3-2-4-6-9/h2-6H,7-8H2,1H3,(H,13,19)