[(4-fluorophenyl)sulfonyl-methyl-amino] 1-ethyl-3-phenyl-pyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: [(4-fluorophenyl)sulfonyl-methyl-amino] 1-ethyl-3-phenyl-pyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: [(4-fluorophenyl)sulfonyl-methyl-amino] 1-ethyl-3-phenyl-pyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 1-ethyl-3-phenyl-5-pyrazolo[3,4-b]pyridinecarboxylic acid [(4-fluorophenyl)sulfonyl-methylamino] ester IUPAC Name: [(4-fluorophenyl)sulfonyl-methylamino] 1-ethyl-3-phenylpyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 1-ethyl-3-phenyl-pyrazolo[3,4-b]pyridine-5-carboxylic acid [(4-fluorophenyl)sulfonyl-methyl-amino] ester Formula: C22H19FN4O4S MolecularWeight: 454.474063

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=NC=C(C=C2C(=N1)C3=CC=CC=C3)C(=O)ON(C)S(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CCN1C2=NC=C(C=C2C(=N1)C3=CC=CC=C3)C(=O)ON(C)S(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H19FN4O4S/c1-3-27-21-19(20(25-27)15-7-5-4-6-8-15)13-16(14-24-21)22(28)31-26(2)32(29,30)18-11-9-17(23)10-12-18/h4-14H,3H2,1-2H3