[4-[(4-methoxyphenyl)sulfonylmethyl-thiophen-2-yl-amino]-1,3-dimethyl-pyrazolo[3,4-b]pyridin-5-yl] N-oxidanylcarbamate

Systemtic Name: [4-[(4-methoxyphenyl)sulfonylmethyl-thiophen-2-yl-amino]-1,3-dimethyl-pyrazolo[3,4-b]pyridin-5-yl] N-oxidanylcarbamate Openeye Name: [4-[(4-methoxyphenyl)sulfonylmethyl-(2-thienyl)amino]-1,3-dimethyl-pyrazolo[3,4-b]pyridin-5-yl] N-hydroxycarbamate CAS Name: N-hydroxycarbamic acid [4-[(4-methoxyphenyl)sulfonylmethyl-thiophen-2-ylamino]-1,3-dimethyl-5-pyrazolo[3,4-b]pyridinyl] ester IUPAC Name: [4-[(4-methoxyphenyl)sulfonylmethyl-thiophen-2-ylamino]-1,3-dimethylpyrazolo[3,4-b]pyridin-5-yl] N-hydroxycarbamate Traditional Name: N-hydroxycarbamic acid [4-[(4-methoxyphenyl)sulfonylmethyl-(2-thienyl)amino]-1,3-dimethyl-pyrazolo[3,4-b]pyridin-5-yl] ester Formula: C21H21N5O6S2 MolecularWeight: 503.55134

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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=CS4)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=CS4)OC(=O)NO)C

InChI

InChI=1S/C21H21N5O6S2/c1-13-18-19(16(32-21(27)24-28)11-22-20(18)25(2)23-13)26(17-5-4-10-33-17)12-34(29,30)15-8-6-14(31-3)7-9-15/h4-11,28H,12H2,1-3H3,(H,24,27)