3-(4-methylphenyl)-N-[[5-methylsulfanyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]methyl]propanamide

Systemtic Name: 3-(4-methylphenyl)-N-[[5-methylsulfanyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]methyl]propanamide Openeye Name: N-[(4-benzyl-5-methylsulfanyl-1,2,4-triazol-3-yl)methyl]-3-(p-tolyl)propanamide CAS Name: 3-(4-methylphenyl)-N-[[5-(methylthio)-4-(phenylmethyl)-1,2,4-triazol-3-yl]methyl]propanamide IUPAC Name: N-[(4-benzyl-5-methylsulfanyl-1,2,4-triazol-3-yl)methyl]-3-(4-methylphenyl)propanamide Traditional Name: N-[[4-benzyl-5-(methylthio)-1,2,4-triazol-3-yl]methyl]-3-(p-tolyl)propionamide Formula: C21H24N4OS MolecularWeight: 380.50646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CCC(=O)NCC2=NN=C(N2CC3=CC=CC=C3)SC

Isomeric SMILES

CC1=CC=C(C=C1)CCC(=O)NCC2=NN=C(N2CC3=CC=CC=C3)SC

InChI

InChI=1S/C21H24N4OS/c1-16-8-10-17(11-9-16)12-13-20(26)22-14-19-23-24-21(27-2)25(19)15-18-6-4-3-5-7-18/h3-11H,12-15H2,1-2H3,(H,22,26)