5-cyclopropyl-2-[[(2,4-dimethylphenyl)methyl-methyl-amino]methyl]-4-(phenylmethyl)-1,2,4-triazole-3-thione

Systemtic Name: 5-cyclopropyl-2-[[(2,4-dimethylphenyl)methyl-methyl-amino]methyl]-4-(phenylmethyl)-1,2,4-triazole-3-thione Openeye Name: 4-benzyl-5-cyclopropyl-2-[[(2,4-dimethylphenyl)methyl-methyl-amino]methyl]-1,2,4-triazole-3-thione CAS Name: 5-cyclopropyl-2-[[(2,4-dimethylphenyl)methyl-methylamino]methyl]-4-(phenylmethyl)-1,2,4-triazole-3-thione IUPAC Name: 4-benzyl-5-cyclopropyl-2-[[(2,4-dimethylphenyl)methyl-methylamino]methyl]-1,2,4-triazole-3-thione Traditional Name: 4-benzyl-5-cyclopropyl-2-[[(2,4-dimethylbenzyl)-methyl-amino]methyl]-1,2,4-triazole-3-thione Formula: C23H28N4S MolecularWeight: 392.56022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CN(C)CN2C(=S)N(C(=N2)C3CC3)CC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C=C1)CN(C)CN2C(=S)N(C(=N2)C3CC3)CC4=CC=CC=C4)C

InChI

InChI=1S/C23H28N4S/c1-17-9-10-21(18(2)13-17)15-25(3)16-27-23(28)26(22(24-27)20-11-12-20)14-19-7-5-4-6-8-19/h4-10,13,20H,11-12,14-16H2,1-3H3