4-[(4-methoxyphenyl)sulfonyl-(pyridin-3-ylmethyl)amino]-6-methyl-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxylic acid

Systemtic Name: 4-[(4-methoxyphenyl)sulfonyl-(pyridin-3-ylmethyl)amino]-6-methyl-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxylic acid Openeye Name: 4-[(4-methoxyphenyl)sulfonyl-(3-pyridylmethyl)amino]-6-methyl-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxylic acid CAS Name: 4-[(4-methoxyphenyl)sulfonyl-(3-pyridinylmethyl)amino]-6-methyl-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxylic acid IUPAC Name: 4-[(4-methoxyphenyl)sulfonyl-(pyridin-3-ylmethyl)amino]-6-methyl-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxylic acid Traditional Name: 4-[(4-methoxyphenyl)sulfonyl-(3-pyridylmethyl)amino]-6-methyl-3-phenyl-2H-pyrazolo[3,4-b]pyridine-5-carboxylic acid Formula: C27H23N5O5S MolecularWeight: 529.56702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=NNC(=C2C(=C1C(=O)O)N(CC3=CN=CC=C3)S(=O)(=O)C4=CC=C(C=C4)OC)C5=CC=CC=C5

Isomeric SMILES

CC1=NC2=NNC(=C2C(=C1C(=O)O)N(CC3=CN=CC=C3)S(=O)(=O)C4=CC=C(C=C4)OC)C5=CC=CC=C5

InChI

InChI=1S/C27H23N5O5S/c1-17-22(27(33)34)25(23-24(30-31-26(23)29-17)19-8-4-3-5-9-19)32(16-18-7-6-14-28-15-18)38(35,36)21-12-10-20(37-2)11-13-21/h3-15H,16H2,1-2H3,(H,33,34)(H,29,30,31)