N-(3-cyclopentylsulfonylphenyl)-1,3-dimethyl-pyrazolo[3,4-b]pyridine-5-carboxamide

Systemtic Name: N-(3-cyclopentylsulfonylphenyl)-1,3-dimethyl-pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: N-(3-cyclopentylsulfonylphenyl)-1,3-dimethyl-pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: N-(3-cyclopentylsulfonylphenyl)-1,3-dimethyl-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-(3-cyclopentylsulfonylphenyl)-1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: N-(3-cyclopentylsulfonylphenyl)-1,3-dimethyl-pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C20H22N4O3S MolecularWeight: 398.47868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=NC=C(C=C12)C(=O)NC3=CC(=CC=C3)S(=O)(=O)C4CCCC4)C

Isomeric SMILES

CC1=NN(C2=NC=C(C=C12)C(=O)NC3=CC(=CC=C3)S(=O)(=O)C4CCCC4)C

InChI

InChI=1S/C20H22N4O3S/c1-13-18-10-14(12-21-19(18)24(2)23-13)20(25)22-15-6-5-9-17(11-15)28(26,27)16-7-3-4-8-16/h5-6,9-12,16H,3-4,7-8H2,1-2H3,(H,22,25)