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

Systemtic Name: 2-[[(2,4-dimethylphenyl)methyl-methyl-amino]methyl]-5-methyl-4-(phenylmethyl)-1,2,4-triazole-3-thione Openeye Name: 4-benzyl-2-[[(2,4-dimethylphenyl)methyl-methyl-amino]methyl]-5-methyl-1,2,4-triazole-3-thione CAS Name: 2-[[(2,4-dimethylphenyl)methyl-methylamino]methyl]-5-methyl-4-(phenylmethyl)-1,2,4-triazole-3-thione IUPAC Name: 4-benzyl-2-[[(2,4-dimethylphenyl)methyl-methylamino]methyl]-5-methyl-1,2,4-triazole-3-thione Traditional Name: 4-benzyl-2-[[(2,4-dimethylbenzyl)-methyl-amino]methyl]-5-methyl-1,2,4-triazole-3-thione Formula: C21H26N4S MolecularWeight: 366.52294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CN(C)CN2C(=S)N(C(=N2)C)CC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=C(C=C1)CN(C)CN2C(=S)N(C(=N2)C)CC3=CC=CC=C3)C

InChI

InChI=1S/C21H26N4S/c1-16-10-11-20(17(2)12-16)14-23(4)15-25-21(26)24(18(3)22-25)13-19-8-6-5-7-9-19/h5-12H,13-15H2,1-4H3