4-[(4-but-2-ynoxyphenyl)sulfonylmethylamino]-1,3-dimethyl-N-oxidanyl-pyrazolo[3,4-b]pyridine-5-carboxamide

Systemtic Name: 4-[(4-but-2-ynoxyphenyl)sulfonylmethylamino]-1,3-dimethyl-N-oxidanyl-pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: 4-[(4-but-2-ynoxyphenyl)sulfonylmethylamino]-1,3-dimethyl-pyrazolo[3,4-b]pyridine-5-carbohydroxamic acid CAS Name: 4-[(4-but-2-ynoxyphenyl)sulfonylmethylamino]-N-hydroxy-1,3-dimethyl-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 4-[(4-but-2-ynoxyphenyl)sulfonylmethylamino]-N-hydroxy-1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: 4-[(4-but-2-ynoxyphenyl)sulfonylmethylamino]-1,3-dimethyl-pyrazolo[3,4-b]pyridine-5-carbohydroxamic acid Formula: C20H21N5O5S MolecularWeight: 443.47624

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=CC=C(C=C1)S(=O)(=O)CNC2=C3C(=NN(C3=NC=C2C(=O)NO)C)C

Isomeric SMILES

CC#CCOC1=CC=C(C=C1)S(=O)(=O)CNC2=C3C(=NN(C3=NC=C2C(=O)NO)C)C

InChI

InChI=1S/C20H21N5O5S/c1-4-5-10-30-14-6-8-15(9-7-14)31(28,29)12-22-18-16(20(26)24-27)11-21-19-17(18)13(2)23-25(19)3/h6-9,11,27H,10,12H2,1-3H3,(H,21,22)(H,24,26)