3,4-dimethoxy-N-[[4-(2-methylpropyl)-5-phenethylsulfanyl-1,2,4-triazol-3-yl]methyl]benzamide

Systemtic Name: 3,4-dimethoxy-N-[[4-(2-methylpropyl)-5-phenethylsulfanyl-1,2,4-triazol-3-yl]methyl]benzamide Openeye Name: N-[(4-isobutyl-5-phenethylsulfanyl-1,2,4-triazol-3-yl)methyl]-3,4-dimethoxy-benzamide CAS Name: 3,4-dimethoxy-N-[[4-(2-methylpropyl)-5-(phenethylthio)-1,2,4-triazol-3-yl]methyl]benzamide IUPAC Name: 3,4-dimethoxy-N-[[4-(2-methylpropyl)-5-phenethylsulfanyl-1,2,4-triazol-3-yl]methyl]benzamide Traditional Name: N-[[4-isobutyl-5-(phenethylthio)-1,2,4-triazol-3-yl]methyl]-3,4-dimethoxy-benzamide Formula: C24H30N4O3S MolecularWeight: 454.585

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=NN=C1SCCC2=CC=CC=C2)CNC(=O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC(C)CN1C(=NN=C1SCCC2=CC=CC=C2)CNC(=O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C24H30N4O3S/c1-17(2)16-28-22(26-27-24(28)32-13-12-18-8-6-5-7-9-18)15-25-23(29)19-10-11-20(30-3)21(14-19)31-4/h5-11,14,17H,12-13,15-16H2,1-4H3,(H,25,29)