ethyl 4-[(4-methoxyphenyl)sulfonyl-(pyridin-3-ylmethyl)amino]-3-methyl-1-phenyl-pyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: ethyl 4-[(4-methoxyphenyl)sulfonyl-(pyridin-3-ylmethyl)amino]-3-methyl-1-phenyl-pyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: ethyl 4-[(4-methoxyphenyl)sulfonyl-(3-pyridylmethyl)amino]-3-methyl-1-phenyl-pyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 4-[(4-methoxyphenyl)sulfonyl-(3-pyridinylmethyl)amino]-3-methyl-1-phenyl-5-pyrazolo[3,4-b]pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(4-methoxyphenyl)sulfonyl-(pyridin-3-ylmethyl)amino]-3-methyl-1-phenylpyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 4-[(4-methoxyphenyl)sulfonyl-(3-pyridylmethyl)amino]-3-methyl-1-phenyl-pyrazolo[3,4-b]pyridine-5-carboxylic acid ethyl ester Formula: C29H27N5O5S MolecularWeight: 557.62018

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C(=C1N(CC3=CN=CC=C3)S(=O)(=O)C4=CC=C(C=C4)OC)C(=NN2C5=CC=CC=C5)C

Isomeric SMILES

CCOC(=O)C1=CN=C2C(=C1N(CC3=CN=CC=C3)S(=O)(=O)C4=CC=C(C=C4)OC)C(=NN2C5=CC=CC=C5)C

InChI

InChI=1S/C29H27N5O5S/c1-4-39-29(35)25-18-31-28-26(20(2)32-34(28)22-10-6-5-7-11-22)27(25)33(19-21-9-8-16-30-17-21)40(36,37)24-14-12-23(38-3)13-15-24/h5-18H,4,19H2,1-3H3