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

Systemtic Name: N-cyclopropyl-2-[[5-methyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-2-phenyl-ethanamide Openeye Name: 2-[(4-benzyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-cyclopropyl-2-phenyl-acetamide CAS Name: N-cyclopropyl-2-[[5-methyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]thio]-2-phenylacetamide IUPAC Name: 2-[(4-benzyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-cyclopropyl-2-phenylacetamide Traditional Name: 2-[(4-benzyl-5-methyl-1,2,4-triazol-3-yl)thio]-N-cyclopropyl-2-phenyl-acetamide Formula: C21H22N4OS MolecularWeight: 378.49058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1CC2=CC=CC=C2)SC(C3=CC=CC=C3)C(=O)NC4CC4

Isomeric SMILES

CC1=NN=C(N1CC2=CC=CC=C2)SC(C3=CC=CC=C3)C(=O)NC4CC4

InChI

InChI=1S/C21H22N4OS/c1-15-23-24-21(25(15)14-16-8-4-2-5-9-16)27-19(17-10-6-3-7-11-17)20(26)22-18-12-13-18/h2-11,18-19H,12-14H2,1H3,(H,22,26)