ethyl 4-[6-methyl-1-(thiophen-2-ylmethyl)pyrazolo[3,4-b]pyridin-4-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[6-methyl-1-(thiophen-2-ylmethyl)pyrazolo[3,4-b]pyridin-4-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[6-methyl-1-(2-thienylmethyl)pyrazolo[3,4-b]pyridine-4-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[6-methyl-1-(thiophen-2-ylmethyl)-4-pyrazolo[3,4-b]pyridinyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[6-methyl-1-(thiophen-2-ylmethyl)pyrazolo[3,4-b]pyridine-4-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[6-methyl-1-(2-thenyl)pyrazolo[3,4-b]pyridine-4-carbonyl]piperazine-1-carboxylic acid ethyl ester Formula: C20H23N5O3S MolecularWeight: 413.49332

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CC(=NC3=C2C=NN3CC4=CC=CS4)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC(=NC3=C2C=NN3CC4=CC=CS4)C

InChI

InChI=1S/C20H23N5O3S/c1-3-28-20(27)24-8-6-23(7-9-24)19(26)16-11-14(2)22-18-17(16)12-21-25(18)13-15-5-4-10-29-15/h4-5,10-12H,3,6-9,13H2,1-2H3