1-(5-aminocarbonyl-1-methyl-pyrrol-3-yl)sulfonyl-N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)piperidine-4-carboxamide

Systemtic Name: 1-(5-aminocarbonyl-1-methyl-pyrrol-3-yl)sulfonyl-N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)piperidine-4-carboxamide Openeye Name: 1-(5-carbamoyl-1-methyl-pyrrol-3-yl)sulfonyl-N-(1-isopropylpyrazolo[3,4-b]pyridin-5-yl)piperidine-4-carboxamide CAS Name: 1-[(5-carbamoyl-1-methyl-3-pyrrolyl)sulfonyl]-N-(1-propan-2-yl-5-pyrazolo[3,4-b]pyridinyl)-4-piperidinecarboxamide IUPAC Name: 1-(5-carbamoyl-1-methylpyrrol-3-yl)sulfonyl-N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)piperidine-4-carboxamide Traditional Name: 1-(5-carbamoyl-1-methyl-pyrrol-3-yl)sulfonyl-N-(1-isopropylpyrazolo[3,4-b]pyridin-5-yl)isonipecotamide Formula: C21H27N7O4S MolecularWeight: 473.54858

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=NC=C(C=C2C=N1)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CN(C(=C4)C(=O)N)C

Isomeric SMILES

CC(C)N1C2=NC=C(C=C2C=N1)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CN(C(=C4)C(=O)N)C

InChI

InChI=1S/C21H27N7O4S/c1-13(2)28-20-15(10-24-28)8-16(11-23-20)25-21(30)14-4-6-27(7-5-14)33(31,32)17-9-18(19(22)29)26(3)12-17/h8-14H,4-7H2,1-3H3,(H2,22,29)(H,25,30)