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

Systemtic Name: N-(2-cyanoethyl)-2-[[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-methyl-ethanamide Openeye Name: N-(2-cyanoethyl)-2-[[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-methyl-acetamide CAS Name: N-(2-cyanoethyl)-2-[[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-N-methylacetamide IUPAC Name: N-(2-cyanoethyl)-2-[[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-methylacetamide Traditional Name: N-(2-cyanoethyl)-2-[[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-N-methyl-acetamide Formula: C15H17N5O2S MolecularWeight: 331.39278

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17N5O2S/c1-19(8-4-7-16)14(21)10-23-15-18-17-11-20(15)12-5-3-6-13(9-12)22-2/h3,5-6,9,11H,4,8,10H2,1-2H3