ethyl 1-[7-(5-chloranylthiophen-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-[7-(5-chloranylthiophen-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-[7-(5-chloro-2-thienyl)pyrazolo[1,5-a]pyrimidine-3-carbonyl]piperidine-3-carboxylate CAS Name: 1-[[7-(5-chloro-2-thiophenyl)-3-pyrazolo[1,5-a]pyrimidinyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[7-(5-chlorothiophen-2-yl)pyrazolo[1,5-a]pyrimidine-3-carbonyl]piperidine-3-carboxylate Traditional Name: 1-[7-(5-chloro-2-thienyl)pyrazolo[1,5-a]pyrimidine-3-carbonyl]nipecotic acid ethyl ester Formula: C19H19ClN4O3S MolecularWeight: 418.89716

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2=C3N=CC=C(N3N=C2)C4=CC=C(S4)Cl

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2=C3N=CC=C(N3N=C2)C4=CC=C(S4)Cl

InChI

InChI=1S/C19H19ClN4O3S/c1-2-27-19(26)12-4-3-9-23(11-12)18(25)13-10-22-24-14(7-8-21-17(13)24)15-5-6-16(20)28-15/h5-8,10,12H,2-4,9,11H2,1H3