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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=C(N(N=C2)C3=NC=CC(=N3)C4=CC=CC=C4OC)C5CC5

Isomeric SMILES

CCOC(=O)C1CCN(CC1)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)18-11-14-30(15-12-18)24(32)20-16-28-31(23(20)17-8-9-17)26-27-13-10-21(29-26)19-6-4-5-7-22(19)34-2/h4-7,10,13,16-18H,3,8-9,11-12,14-15H2,1-2H3