ethyl 1-[6-(2,5-dimethylthiophen-3-yl)-1-propan-2-yl-pyrazolo[3,4-b]pyridin-4-yl]carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-[6-(2,5-dimethylthiophen-3-yl)-1-propan-2-yl-pyrazolo[3,4-b]pyridin-4-yl]carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-[6-(2,5-dimethyl-3-thienyl)-1-isopropyl-pyrazolo[3,4-b]pyridine-4-carbonyl]piperidine-3-carboxylate CAS Name: 1-[[6-(2,5-dimethyl-3-thiophenyl)-1-propan-2-yl-4-pyrazolo[3,4-b]pyridinyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[6-(2,5-dimethylthiophen-3-yl)-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carbonyl]piperidine-3-carboxylate Traditional Name: 1-[6-(2,5-dimethyl-3-thienyl)-1-isopropyl-pyrazolo[3,4-b]pyridine-4-carbonyl]nipecotic acid ethyl ester Formula: C24H30N4O3S MolecularWeight: 454.585

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2=CC(=NC3=C2C=NN3C(C)C)C4=C(SC(=C4)C)C

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2=CC(=NC3=C2C=NN3C(C)C)C4=C(SC(=C4)C)C

InChI

InChI=1S/C24H30N4O3S/c1-6-31-24(30)17-8-7-9-27(13-17)23(29)19-11-21(18-10-15(4)32-16(18)5)26-22-20(19)12-25-28(22)14(2)3/h10-12,14,17H,6-9,13H2,1-5H3