[4-[(4-methoxyphenyl)sulfonylmethyl-pyridin-3-yl-amino]-1-methyl-3-phenyl-pyrazolo[3,4-b]pyridin-5-yl] N-oxidanylcarbamate

Systemtic Name: [4-[(4-methoxyphenyl)sulfonylmethyl-pyridin-3-yl-amino]-1-methyl-3-phenyl-pyrazolo[3,4-b]pyridin-5-yl] N-oxidanylcarbamate Openeye Name: [4-[(4-methoxyphenyl)sulfonylmethyl-(3-pyridyl)amino]-1-methyl-3-phenyl-pyrazolo[3,4-b]pyridin-5-yl] N-hydroxycarbamate CAS Name: N-hydroxycarbamic acid [4-[(4-methoxyphenyl)sulfonylmethyl-(3-pyridinyl)amino]-1-methyl-3-phenyl-5-pyrazolo[3,4-b]pyridinyl] ester IUPAC Name: [4-[(4-methoxyphenyl)sulfonylmethyl-pyridin-3-ylamino]-1-methyl-3-phenylpyrazolo[3,4-b]pyridin-5-yl] N-hydroxycarbamate Traditional Name: N-hydroxycarbamic acid [4-[(4-methoxyphenyl)sulfonylmethyl-(3-pyridyl)amino]-1-methyl-3-phenyl-pyrazolo[3,4-b]pyridin-5-yl] ester Formula: C27H24N6O6S MolecularWeight: 560.58106

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=NC=C(C(=C2C(=N1)C3=CC=CC=C3)N(CS(=O)(=O)C4=CC=C(C=C4)OC)C5=CN=CC=C5)OC(=O)NO

Isomeric SMILES

CN1C2=NC=C(C(=C2C(=N1)C3=CC=CC=C3)N(CS(=O)(=O)C4=CC=C(C=C4)OC)C5=CN=CC=C5)OC(=O)NO

InChI

InChI=1S/C27H24N6O6S/c1-32-26-23(24(30-32)18-7-4-3-5-8-18)25(22(16-29-26)39-27(34)31-35)33(19-9-6-14-28-15-19)17-40(36,37)21-12-10-20(38-2)11-13-21/h3-16,35H,17H2,1-2H3,(H,31,34)