4-[(1-aminocarbonylpiperidin-4-yl)amino]-1-ethyl-N-[(2-thiophen-3-ylphenyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide

Systemtic Name: 4-[(1-aminocarbonylpiperidin-4-yl)amino]-1-ethyl-N-[(2-thiophen-3-ylphenyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: 4-[(1-carbamoyl-4-piperidyl)amino]-1-ethyl-N-[[2-(3-thienyl)phenyl]methyl]pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: 4-[(1-carbamoyl-4-piperidinyl)amino]-1-ethyl-N-[[2-(3-thiophenyl)phenyl]methyl]-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 4-[(1-carbamoylpiperidin-4-yl)amino]-1-ethyl-N-[(2-thiophen-3-ylphenyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: 4-[(1-carbamoyl-4-piperidyl)amino]-1-ethyl-N-[2-(3-thienyl)benzyl]pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C26H29N7O2S MolecularWeight: 503.61916

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=NC=C(C(=C2C=N1)NC3CCN(CC3)C(=O)N)C(=O)NCC4=CC=CC=C4C5=CSC=C5

Isomeric SMILES

CCN1C2=NC=C(C(=C2C=N1)NC3CCN(CC3)C(=O)N)C(=O)NCC4=CC=CC=C4C5=CSC=C5

InChI

InChI=1S/C26H29N7O2S/c1-2-33-24-21(15-30-33)23(31-19-7-10-32(11-8-19)26(27)35)22(14-28-24)25(34)29-13-17-5-3-4-6-20(17)18-9-12-36-16-18/h3-6,9,12,14-16,19H,2,7-8,10-11,13H2,1H3,(H2,27,35)(H,28,31)(H,29,34)