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

Systemtic Name: N-(2-cyanoethyl)-N-methyl-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanamide Openeye Name: N-(2-cyanoethyl)-N-methyl-2-(1-phenyltetrazol-5-yl)sulfanyl-acetamide CAS Name: N-(2-cyanoethyl)-N-methyl-2-[(1-phenyl-5-tetrazolyl)thio]acetamide IUPAC Name: N-(2-cyanoethyl)-N-methyl-2-(1-phenyltetrazol-5-yl)sulfanylacetamide Traditional Name: N-(2-cyanoethyl)-N-methyl-2-[(1-phenyltetrazol-5-yl)thio]acetamide Formula: C13H14N6OS MolecularWeight: 302.35486

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)C(=O)CSC1=NN=NN1C2=CC=CC=C2

Isomeric SMILES

CN(CCC#N)C(=O)CSC1=NN=NN1C2=CC=CC=C2

InChI

InChI=1S/C13H14N6OS/c1-18(9-5-8-14)12(20)10-21-13-15-16-17-19(13)11-6-3-2-4-7-11/h2-4,6-7H,5,9-10H2,1H3