5-(4-methylphenyl)-2-[(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methyl]-1H-1,2,4-triazole-3-thione

Systemtic Name: 5-(4-methylphenyl)-2-[(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methyl]-1H-1,2,4-triazole-3-thione Openeye Name: 2-[(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methyl]-5-(p-tolyl)-1H-1,2,4-triazole-3-thione CAS Name: 5-(4-methylphenyl)-2-[(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methyl]-1H-1,2,4-triazole-3-thione IUPAC Name: 5-(4-methylphenyl)-2-[(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methyl]-1H-1,2,4-triazole-3-thione Traditional Name: 2-[(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methyl]-5-(p-tolyl)-1H-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=C(C=C1)C2=NC(=S)N(N2)CN3CCC(=CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=S)N(N2)CN3CCC(=CC3)C4=CC=CC=C4

InChI

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