ethyl 1-[5-cyclopropyl-1-[4-(2-methoxyphenyl)pyrimidin-2-yl]pyrazol-4-yl]carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-[5-cyclopropyl-1-[4-(2-methoxyphenyl)pyrimidin-2-yl]pyrazol-4-yl]carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-[5-cyclopropyl-1-[4-(2-methoxyphenyl)pyrimidin-2-yl]pyrazole-4-carbonyl]piperidine-3-carboxylate CAS Name: 1-[[5-cyclopropyl-1-[4-(2-methoxyphenyl)-2-pyrimidinyl]-4-pyrazolyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[5-cyclopropyl-1-[4-(2-methoxyphenyl)pyrimidin-2-yl]pyrazole-4-carbonyl]piperidine-3-carboxylate Traditional Name: 1-[5-cyclopropyl-1-[4-(2-methoxyphenyl)pyrimidin-2-yl]pyrazole-4-carbonyl]nipecotic acid ethyl ester Formula: C26H29N5O4 MolecularWeight: 475.53956

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2=C(N(N=C2)C3=NC=CC(=N3)C4=CC=CC=C4OC)C5CC5

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2=C(N(N=C2)C3=NC=CC(=N3)C4=CC=CC=C4OC)C5CC5

InChI

InChI=1S/C26H29N5O4/c1-3-35-25(33)18-7-6-14-30(16-18)24(32)20-15-28-31(23(20)17-10-11-17)26-27-13-12-21(29-26)19-8-4-5-9-22(19)34-2/h4-5,8-9,12-13,15,17-18H,3,6-7,10-11,14,16H2,1-2H3