3-[2-(2,5-dimethylphenyl)quinolin-4-yl]-4-(2-methylpropyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[2-(2,5-dimethylphenyl)quinolin-4-yl]-4-(2-methylpropyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-[2-(2,5-dimethylphenyl)-4-quinolyl]-4-isobutyl-1H-1,2,4-triazole-5-thione CAS Name: 3-[2-(2,5-dimethylphenyl)-4-quinolinyl]-4-(2-methylpropyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[2-(2,5-dimethylphenyl)quinolin-4-yl]-4-(2-methylpropyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-[2-(2,5-dimethylphenyl)-4-quinolyl]-4-isobutyl-1H-1,2,4-triazole-5-thione Formula: C23H24N4S MolecularWeight: 388.52846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2=NC3=CC=CC=C3C(=C2)C4=NNC(=S)N4CC(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)C2=NC3=CC=CC=C3C(=C2)C4=NNC(=S)N4CC(C)C

InChI

InChI=1S/C23H24N4S/c1-14(2)13-27-22(25-26-23(27)28)19-12-21(18-11-15(3)9-10-16(18)4)24-20-8-6-5-7-17(19)20/h5-12,14H,13H2,1-4H3,(H,26,28)