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

Systemtic Name: [4-[(4-methoxyphenyl)sulfonylmethyl-pyridin-4-yl-amino]-1,3-dimethyl-pyrazolo[3,4-b]pyridin-5-yl] N-oxidanylcarbamate Openeye Name: [4-[(4-methoxyphenyl)sulfonylmethyl-(4-pyridyl)amino]-1,3-dimethyl-pyrazolo[3,4-b]pyridin-5-yl] N-hydroxycarbamate CAS Name: N-hydroxycarbamic acid [4-[(4-methoxyphenyl)sulfonylmethyl-pyridin-4-ylamino]-1,3-dimethyl-5-pyrazolo[3,4-b]pyridinyl] ester IUPAC Name: [4-[(4-methoxyphenyl)sulfonylmethyl-pyridin-4-ylamino]-1,3-dimethylpyrazolo[3,4-b]pyridin-5-yl] N-hydroxycarbamate Traditional Name: N-hydroxycarbamic acid [4-[(4-methoxyphenyl)sulfonylmethyl-(4-pyridyl)amino]-1,3-dimethyl-pyrazolo[3,4-b]pyridin-5-yl] ester Formula: C22H22N6O6S MolecularWeight: 498.51168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=NC=C(C(=C12)N(CS(=O)(=O)C3=CC=C(C=C3)OC)C4=CC=NC=C4)OC(=O)NO)C

Isomeric SMILES

CC1=NN(C2=NC=C(C(=C12)N(CS(=O)(=O)C3=CC=C(C=C3)OC)C4=CC=NC=C4)OC(=O)NO)C

InChI

InChI=1S/C22H22N6O6S/c1-14-19-20(18(34-22(29)26-30)12-24-21(19)27(2)25-14)28(15-8-10-23-11-9-15)13-35(31,32)17-6-4-16(33-3)5-7-17/h4-12,30H,13H2,1-3H3,(H,26,29)