3-methyl-4-(4-methylphenyl)-1-(8-oxidanylquinolin-5-yl)sulfonyl-4,5-dihydro-3aH-pyrazolo[3,4-d]pyrimidine-6-thione

Systemtic Name: 3-methyl-4-(4-methylphenyl)-1-(8-oxidanylquinolin-5-yl)sulfonyl-4,5-dihydro-3aH-pyrazolo[3,4-d]pyrimidine-6-thione Openeye Name: 1-[(8-hydroxy-5-quinolyl)sulfonyl]-3-methyl-4-(p-tolyl)-4,5-dihydro-3aH-pyrazolo[3,4-d]pyrimidine-6-thione CAS Name: 1-[(8-hydroxy-5-quinolinyl)sulfonyl]-3-methyl-4-(4-methylphenyl)-4,5-dihydro-3aH-pyrazolo[3,4-d]pyrimidine-6-thione IUPAC Name: 1-(8-hydroxyquinolin-5-yl)sulfonyl-3-methyl-4-(4-methylphenyl)-4,5-dihydro-3aH-pyrazolo[3,4-d]pyrimidine-6-thione Traditional Name: 1-[(8-hydroxy-5-quinolyl)sulfonyl]-3-methyl-4-(p-tolyl)-4,5-dihydro-3aH-pyrazolo[3,4-d]pyrimidine-6-thione Formula: C22H19N5O3S2 MolecularWeight: 465.54796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C3C(=NN(C3=NC(=S)N2)S(=O)(=O)C4=C5C=CC=NC5=C(C=C4)O)C

Isomeric SMILES

CC1=CC=C(C=C1)C2C3C(=NN(C3=NC(=S)N2)S(=O)(=O)C4=C5C=CC=NC5=C(C=C4)O)C

InChI

InChI=1S/C22H19N5O3S2/c1-12-5-7-14(8-6-12)19-18-13(2)26-27(21(18)25-22(31)24-19)32(29,30)17-10-9-16(28)20-15(17)4-3-11-23-20/h3-11,18-19,28H,1-2H3,(H,24,31)