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

Systemtic Name: N-(2-cyanoethyl)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-phenyl-ethanamide Openeye Name: N-(2-cyanoethyl)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-phenyl-acetamide CAS Name: N-(2-cyanoethyl)-2-[(4-methyl-1,2,4-triazol-3-yl)thio]-N-phenylacetamide IUPAC Name: N-(2-cyanoethyl)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-phenylacetamide Traditional Name: N-(2-cyanoethyl)-2-[(4-methyl-1,2,4-triazol-3-yl)thio]-N-phenyl-acetamide Formula: C14H15N5OS MolecularWeight: 301.3668

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15N5OS/c1-18-11-16-17-14(18)21-10-13(20)19(9-5-8-15)12-6-3-2-4-7-12/h2-4,6-7,11H,5,9-10H2,1H3