N-[[5-ethylsulfanyl-4-(3-methylphenyl)-1,2,4-triazol-3-yl]methyl]-3,4-dimethyl-benzamide

Systemtic Name: N-[[5-ethylsulfanyl-4-(3-methylphenyl)-1,2,4-triazol-3-yl]methyl]-3,4-dimethyl-benzamide Openeye Name: N-[[5-ethylsulfanyl-4-(m-tolyl)-1,2,4-triazol-3-yl]methyl]-3,4-dimethyl-benzamide CAS Name: N-[[5-(ethylthio)-4-(3-methylphenyl)-1,2,4-triazol-3-yl]methyl]-3,4-dimethylbenzamide IUPAC Name: N-[[5-ethylsulfanyl-4-(3-methylphenyl)-1,2,4-triazol-3-yl]methyl]-3,4-dimethylbenzamide Traditional Name: N-[[5-(ethylthio)-4-(m-tolyl)-1,2,4-triazol-3-yl]methyl]-3,4-dimethyl-benzamide Formula: C21H24N4OS MolecularWeight: 380.50646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(N1C2=CC=CC(=C2)C)CNC(=O)C3=CC(=C(C=C3)C)C

Isomeric SMILES

CCSC1=NN=C(N1C2=CC=CC(=C2)C)CNC(=O)C3=CC(=C(C=C3)C)C

InChI

InChI=1S/C21H24N4OS/c1-5-27-21-24-23-19(25(21)18-8-6-7-14(2)11-18)13-22-20(26)17-10-9-15(3)16(4)12-17/h6-12H,5,13H2,1-4H3,(H,22,26)