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

Systemtic Name: N-(2-cyanoethyl)-2-[(5-cyclopropyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-phenyl-ethanamide Openeye Name: N-(2-cyanoethyl)-2-[(5-cyclopropyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-phenyl-acetamide CAS Name: N-(2-cyanoethyl)-2-[(5-cyclopropyl-4-methyl-1,2,4-triazol-3-yl)thio]-N-phenylacetamide IUPAC Name: N-(2-cyanoethyl)-2-[(5-cyclopropyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-phenylacetamide Traditional Name: N-(2-cyanoethyl)-2-[(5-cyclopropyl-4-methyl-1,2,4-triazol-3-yl)thio]-N-phenyl-acetamide Formula: C17H19N5OS MolecularWeight: 341.43066

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)N(CCC#N)C2=CC=CC=C2)C3CC3

Isomeric SMILES

CN1C(=NN=C1SCC(=O)N(CCC#N)C2=CC=CC=C2)C3CC3

InChI

InChI=1S/C17H19N5OS/c1-21-16(13-8-9-13)19-20-17(21)24-12-15(23)22(11-5-10-18)14-6-3-2-4-7-14/h2-4,6-7,13H,5,8-9,11-12H2,1H3