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

Systemtic Name: N-cyclopropyl-2-[[4-(2,4-dimethylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-2-phenyl-ethanamide Openeye Name: N-cyclopropyl-2-[[4-(2,4-dimethylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-2-phenyl-acetamide CAS Name: N-cyclopropyl-2-[[4-(2,4-dimethylphenyl)-1,2,4-triazol-3-yl]thio]-2-phenylacetamide IUPAC Name: N-cyclopropyl-2-[[4-(2,4-dimethylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-2-phenylacetamide Traditional Name: N-cyclopropyl-2-[[4-(2,4-dimethylphenyl)-1,2,4-triazol-3-yl]thio]-2-phenyl-acetamide Formula: C21H22N4OS MolecularWeight: 378.49058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C=NN=C2SC(C3=CC=CC=C3)C(=O)NC4CC4)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C=NN=C2SC(C3=CC=CC=C3)C(=O)NC4CC4)C

InChI

InChI=1S/C21H22N4OS/c1-14-8-11-18(15(2)12-14)25-13-22-24-21(25)27-19(16-6-4-3-5-7-16)20(26)23-17-9-10-17/h3-8,11-13,17,19H,9-10H2,1-2H3,(H,23,26)