1,3-dimethyl-4-[methyl-(4-propoxyphenyl)sulfonyl-amino]pyrazolo[3,4-b]pyridine-5-carboxylic acid

Systemtic Name: 1,3-dimethyl-4-[methyl-(4-propoxyphenyl)sulfonyl-amino]pyrazolo[3,4-b]pyridine-5-carboxylic acid Openeye Name: 1,3-dimethyl-4-[methyl-(4-propoxyphenyl)sulfonyl-amino]pyrazolo[3,4-b]pyridine-5-carboxylic acid CAS Name: 1,3-dimethyl-4-[methyl-(4-propoxyphenyl)sulfonylamino]-5-pyrazolo[3,4-b]pyridinecarboxylic acid IUPAC Name: 1,3-dimethyl-4-[methyl-(4-propoxyphenyl)sulfonylamino]pyrazolo[3,4-b]pyridine-5-carboxylic acid Traditional Name: 1,3-dimethyl-4-[methyl-(4-propoxyphenyl)sulfonyl-amino]pyrazolo[3,4-b]pyridine-5-carboxylic acid Formula: C19H22N4O5S MolecularWeight: 418.46678

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)S(=O)(=O)N(C)C2=C3C(=NN(C3=NC=C2C(=O)O)C)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)S(=O)(=O)N(C)C2=C3C(=NN(C3=NC=C2C(=O)O)C)C

InChI

InChI=1S/C19H22N4O5S/c1-5-10-28-13-6-8-14(9-7-13)29(26,27)23(4)17-15(19(24)25)11-20-18-16(17)12(2)21-22(18)3/h6-9,11H,5,10H2,1-4H3,(H,24,25)