methyl 5-bromanyl-2-[(1,3-dimethylpyrazolo[3,4-b]pyridin-5-yl)sulfamoyl]benzoate

Systemtic Name: methyl 5-bromanyl-2-[(1,3-dimethylpyrazolo[3,4-b]pyridin-5-yl)sulfamoyl]benzoate Openeye Name: methyl 5-bromo-2-[(1,3-dimethylpyrazolo[3,4-b]pyridin-5-yl)sulfamoyl]benzoate CAS Name: 5-bromo-2-[(1,3-dimethyl-5-pyrazolo[3,4-b]pyridinyl)sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 5-bromo-2-[(1,3-dimethylpyrazolo[3,4-b]pyridin-5-yl)sulfamoyl]benzoate Traditional Name: 5-bromo-2-[(1,3-dimethylpyrazolo[3,4-b]pyridin-5-yl)sulfamoyl]benzoic acid methyl ester Formula: C16H15BrN4O4S MolecularWeight: 439.2837

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=NC=C(C=C12)NS(=O)(=O)C3=C(C=C(C=C3)Br)C(=O)OC)C

Isomeric SMILES

CC1=NN(C2=NC=C(C=C12)NS(=O)(=O)C3=C(C=C(C=C3)Br)C(=O)OC)C

InChI

InChI=1S/C16H15BrN4O4S/c1-9-12-7-11(8-18-15(12)21(2)19-9)20-26(23,24)14-5-4-10(17)6-13(14)16(22)25-3/h4-8,20H,1-3H3