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

Systemtic Name: 1,6-dimethyl-4-(4-thiophen-2-ylsulfonylpiperazin-1-yl)carbonyl-2H-pyrazolo[3,4-b]pyridin-3-one Openeye Name: 1,6-dimethyl-4-[4-(2-thienylsulfonyl)piperazine-1-carbonyl]-2H-pyrazolo[3,4-b]pyridin-3-one CAS Name: 1,6-dimethyl-4-[oxo-(4-thiophen-2-ylsulfonyl-1-piperazinyl)methyl]-2H-pyrazolo[3,4-b]pyridin-3-one IUPAC Name: 1,6-dimethyl-4-(4-thiophen-2-ylsulfonylpiperazine-1-carbonyl)-2H-pyrazolo[3,4-b]pyridin-3-one Traditional Name: 1,6-dimethyl-4-[4-(2-thienylsulfonyl)piperazine-1-carbonyl]-2H-pyrazolo[3,4-b]pyridin-3-one Formula: C17H19N5O4S2 MolecularWeight: 421.49386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=C1)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CS4)C(=O)NN2C

Isomeric SMILES

CC1=NC2=C(C(=C1)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CS4)C(=O)NN2C

InChI

InChI=1S/C17H19N5O4S2/c1-11-10-12(14-15(18-11)20(2)19-16(14)23)17(24)21-5-7-22(8-6-21)28(25,26)13-4-3-9-27-13/h3-4,9-10H,5-8H2,1-2H3,(H,19,23)