1-[4-(4-chlorophenyl)-3-methyl-1-(8-oxidanylquinolin-5-yl)sulfonyl-3a,4-dihydropyrazolo[3,4-c]pyrazol-5-yl]ethanone

Systemtic Name: 1-[4-(4-chlorophenyl)-3-methyl-1-(8-oxidanylquinolin-5-yl)sulfonyl-3a,4-dihydropyrazolo[3,4-c]pyrazol-5-yl]ethanone Openeye Name: 1-[4-(4-chlorophenyl)-1-[(8-hydroxy-5-quinolyl)sulfonyl]-3-methyl-3a,4-dihydropyrazolo[3,4-c]pyrazol-5-yl]ethanone CAS Name: 1-[4-(4-chlorophenyl)-1-[(8-hydroxy-5-quinolinyl)sulfonyl]-3-methyl-3a,4-dihydropyrazolo[3,4-c]pyrazol-5-yl]ethanone IUPAC Name: 1-[4-(4-chlorophenyl)-1-(8-hydroxyquinolin-5-yl)sulfonyl-3-methyl-3a,4-dihydropyrazolo[3,4-c]pyrazol-5-yl]ethanone Traditional Name: 1-[4-(4-chlorophenyl)-1-[(8-hydroxy-5-quinolyl)sulfonyl]-3-methyl-3a,4-dihydropyrazolo[3,4-c]pyrazol-5-yl]ethanone Formula: C22H18ClN5O4S MolecularWeight: 483.92742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=NN(C(C12)C3=CC=C(C=C3)Cl)C(=O)C)S(=O)(=O)C4=C5C=CC=NC5=C(C=C4)O

Isomeric SMILES

CC1=NN(C2=NN(C(C12)C3=CC=C(C=C3)Cl)C(=O)C)S(=O)(=O)C4=C5C=CC=NC5=C(C=C4)O

InChI

InChI=1S/C22H18ClN5O4S/c1-12-19-21(14-5-7-15(23)8-6-14)27(13(2)29)26-22(19)28(25-12)33(31,32)18-10-9-17(30)20-16(18)4-3-11-24-20/h3-11,19,21,30H,1-2H3