N-(4,6-dimethylpyrimidin-2-yl)-4-(3-quinolin-2-yl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)benzenesulfonamide

Systemtic Name: N-(4,6-dimethylpyrimidin-2-yl)-4-(3-quinolin-2-yl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)benzenesulfonamide Openeye Name: N-(4,6-dimethylpyrimidin-2-yl)-4-[3-(2-quinolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]benzenesulfonamide CAS Name: N-(4,6-dimethyl-2-pyrimidinyl)-4-[3-(2-quinolinyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]benzenesulfonamide IUPAC Name: N-(4,6-dimethylpyrimidin-2-yl)-4-(3-quinolin-2-yl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)benzenesulfonamide Traditional Name: N-(4,6-dimethylpyrimidin-2-yl)-4-[3-(2-quinolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]benzenesulfonamide Formula: C23H19N7O2S2 MolecularWeight: 489.57266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)N3C(=NNC3=S)C4=NC5=CC=CC=C5C=C4)C

Isomeric SMILES

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)N3C(=NNC3=S)C4=NC5=CC=CC=C5C=C4)C

InChI

InChI=1S/C23H19N7O2S2/c1-14-13-15(2)25-22(24-14)29-34(31,32)18-10-8-17(9-11-18)30-21(27-28-23(30)33)20-12-7-16-5-3-4-6-19(16)26-20/h3-13H,1-2H3,(H,28,33)(H,24,25,29)