4-[4-(3-bromophenyl)sulfonylpiperazin-1-yl]carbonyl-1,6-dimethyl-2H-pyrazolo[3,4-b]pyridin-3-one

Systemtic Name: 4-[4-(3-bromophenyl)sulfonylpiperazin-1-yl]carbonyl-1,6-dimethyl-2H-pyrazolo[3,4-b]pyridin-3-one Openeye Name: 4-[4-(3-bromophenyl)sulfonylpiperazine-1-carbonyl]-1,6-dimethyl-2H-pyrazolo[3,4-b]pyridin-3-one CAS Name: 4-[[4-(3-bromophenyl)sulfonyl-1-piperazinyl]-oxomethyl]-1,6-dimethyl-2H-pyrazolo[3,4-b]pyridin-3-one IUPAC Name: 4-[4-(3-bromophenyl)sulfonylpiperazine-1-carbonyl]-1,6-dimethyl-2H-pyrazolo[3,4-b]pyridin-3-one Traditional Name: 4-[4-(3-bromophenyl)sulfonylpiperazine-1-carbonyl]-1,6-dimethyl-2H-pyrazolo[3,4-b]pyridin-3-one Formula: C19H20BrN5O4S MolecularWeight: 494.3622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=C1)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC(=CC=C4)Br)C(=O)NN2C

Isomeric SMILES

CC1=NC2=C(C(=C1)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC(=CC=C4)Br)C(=O)NN2C

InChI

InChI=1S/C19H20BrN5O4S/c1-12-10-15(16-17(21-12)23(2)22-18(16)26)19(27)24-6-8-25(9-7-24)30(28,29)14-5-3-4-13(20)11-14/h3-5,10-11H,6-9H2,1-2H3,(H,22,26)