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

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

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)C(=O)CSC1=NN=CN1C2=CC=CC=C2

Isomeric SMILES

CN(CCC#N)C(=O)CSC1=NN=CN1C2=CC=CC=C2

InChI

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