4-(2-methylphenyl)-2-[(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methyl]-1,2,4-triazole-3-thione

Systemtic Name: 4-(2-methylphenyl)-2-[(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methyl]-1,2,4-triazole-3-thione Openeye Name: 4-(o-tolyl)-2-[(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methyl]-1,2,4-triazole-3-thione CAS Name: 4-(2-methylphenyl)-2-[(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methyl]-1,2,4-triazole-3-thione IUPAC Name: 4-(2-methylphenyl)-2-[(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methyl]-1,2,4-triazole-3-thione Traditional Name: 4-(o-tolyl)-2-[(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methyl]-1,2,4-triazole-3-thione Formula: C21H22N4S MolecularWeight: 362.49118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C=NN(C2=S)CN3CCC(=CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1N2C=NN(C2=S)CN3CCC(=CC3)C4=CC=CC=C4

InChI

InChI=1S/C21H22N4S/c1-17-7-5-6-10-20(17)24-15-22-25(21(24)26)16-23-13-11-19(12-14-23)18-8-3-2-4-9-18/h2-11,15H,12-14,16H2,1H3