3-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-4-quinolin-5-yl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-4-quinolin-5-yl-1H-1,2,4-triazole-5-thione Openeye Name: 3-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-4-(5-quinolyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-[[(4,6-dimethyl-2-pyrimidinyl)thio]methyl]-4-(5-quinolinyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-4-quinolin-5-yl-1H-1,2,4-triazole-5-thione Traditional Name: 3-[[(4,6-dimethylpyrimidin-2-yl)thio]methyl]-4-(5-quinolyl)-1H-1,2,4-triazole-5-thione Formula: C18H16N6S2 MolecularWeight: 380.48984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=NNC(=S)N2C3=CC=CC4=C3C=CC=N4)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=NNC(=S)N2C3=CC=CC4=C3C=CC=N4)C

InChI

InChI=1S/C18H16N6S2/c1-11-9-12(2)21-17(20-11)26-10-16-22-23-18(25)24(16)15-7-3-6-14-13(15)5-4-8-19-14/h3-9H,10H2,1-2H3,(H,23,25)