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

Systemtic Name: ethyl 4-[6-(5-methylthiophen-2-yl)-1-propan-2-yl-pyrazolo[3,4-b]pyridin-4-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[1-isopropyl-6-(5-methyl-2-thienyl)pyrazolo[3,4-b]pyridine-4-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[6-(5-methyl-2-thiophenyl)-1-propan-2-yl-4-pyrazolo[3,4-b]pyridinyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[6-(5-methylthiophen-2-yl)-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[1-isopropyl-6-(5-methyl-2-thienyl)pyrazolo[3,4-b]pyridine-4-carbonyl]piperazine-1-carboxylic acid ethyl ester Formula: C22H27N5O3S MolecularWeight: 441.54648

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CC(=NC3=C2C=NN3C(C)C)C4=CC=C(S4)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC(=NC3=C2C=NN3C(C)C)C4=CC=C(S4)C

InChI

InChI=1S/C22H27N5O3S/c1-5-30-22(29)26-10-8-25(9-11-26)21(28)16-12-18(19-7-6-15(4)31-19)24-20-17(16)13-23-27(20)14(2)3/h6-7,12-14H,5,8-11H2,1-4H3