2-[[(2,4-dimethylphenyl)methyl-methyl-amino]methyl]-4-prop-2-enyl-5-pyridin-3-yl-1,2,4-triazole-3-thione

Systemtic Name: 2-[[(2,4-dimethylphenyl)methyl-methyl-amino]methyl]-4-prop-2-enyl-5-pyridin-3-yl-1,2,4-triazole-3-thione Openeye Name: 4-allyl-2-[[(2,4-dimethylphenyl)methyl-methyl-amino]methyl]-5-(3-pyridyl)-1,2,4-triazole-3-thione CAS Name: 2-[[(2,4-dimethylphenyl)methyl-methylamino]methyl]-4-prop-2-enyl-5-(3-pyridinyl)-1,2,4-triazole-3-thione IUPAC Name: 2-[[(2,4-dimethylphenyl)methyl-methylamino]methyl]-4-prop-2-enyl-5-pyridin-3-yl-1,2,4-triazole-3-thione Traditional Name: 4-allyl-2-[[(2,4-dimethylbenzyl)-methyl-amino]methyl]-5-(3-pyridyl)-1,2,4-triazole-3-thione Formula: C21H25N5S MolecularWeight: 379.5217

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N5S/c1-5-11-25-20(18-7-6-10-22-13-18)23-26(21(25)27)15-24(4)14-19-9-8-16(2)12-17(19)3/h5-10,12-13H,1,11,14-15H2,2-4H3