N-(1,3-dimethylpyrazolo[3,4-b]pyridin-5-yl)-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(1,3-dimethylpyrazolo[3,4-b]pyridin-5-yl)-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(1,3-dimethylpyrazolo[3,4-b]pyridin-5-yl)-1-(p-tolylsulfonyl)piperidine-4-carboxamide CAS Name: N-(1,3-dimethyl-5-pyrazolo[3,4-b]pyridinyl)-1-(4-methylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(1,3-dimethylpyrazolo[3,4-b]pyridin-5-yl)-1-(4-methylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(1,3-dimethylpyrazolo[3,4-b]pyridin-5-yl)-1-tosyl-isonipecotamide Formula: C21H25N5O3S MolecularWeight: 427.5199

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CN=C4C(=C3)C(=NN4C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CN=C4C(=C3)C(=NN4C)C

InChI

InChI=1S/C21H25N5O3S/c1-14-4-6-18(7-5-14)30(28,29)26-10-8-16(9-11-26)21(27)23-17-12-19-15(2)24-25(3)20(19)22-13-17/h4-7,12-13,16H,8-11H2,1-3H3,(H,23,27)