N-[[4-methyl-5-(2-methylpropylsulfanyl)-1,2,4-triazol-3-yl]methyl]-2,2-diphenyl-ethanamide

Systemtic Name: N-[[4-methyl-5-(2-methylpropylsulfanyl)-1,2,4-triazol-3-yl]methyl]-2,2-diphenyl-ethanamide Openeye Name: N-[(5-isobutylsulfanyl-4-methyl-1,2,4-triazol-3-yl)methyl]-2,2-diphenyl-acetamide CAS Name: N-[[4-methyl-5-(2-methylpropylthio)-1,2,4-triazol-3-yl]methyl]-2,2-diphenylacetamide IUPAC Name: N-[[4-methyl-5-(2-methylpropylsulfanyl)-1,2,4-triazol-3-yl]methyl]-2,2-diphenylacetamide Traditional Name: N-[[5-(isobutylthio)-4-methyl-1,2,4-triazol-3-yl]methyl]-2,2-diphenyl-acetamide Formula: C22H26N4OS MolecularWeight: 394.53304

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CSC1=NN=C(N1C)CNC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)CSC1=NN=C(N1C)CNC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H26N4OS/c1-16(2)15-28-22-25-24-19(26(22)3)14-23-21(27)20(17-10-6-4-7-11-17)18-12-8-5-9-13-18/h4-13,16,20H,14-15H2,1-3H3,(H,23,27)