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

Systemtic Name: ethyl 1-[5-cyclopropyl-1-[4-(3-fluoranyl-4-methoxy-phenyl)pyrimidin-2-yl]pyrazol-4-yl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[5-cyclopropyl-1-[4-(3-fluoro-4-methoxy-phenyl)pyrimidin-2-yl]pyrazole-4-carbonyl]piperidine-4-carboxylate CAS Name: 1-[[5-cyclopropyl-1-[4-(3-fluoro-4-methoxyphenyl)-2-pyrimidinyl]-4-pyrazolyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[5-cyclopropyl-1-[4-(3-fluoro-4-methoxyphenyl)pyrimidin-2-yl]pyrazole-4-carbonyl]piperidine-4-carboxylate Traditional Name: 1-[5-cyclopropyl-1-[4-(3-fluoro-4-methoxy-phenyl)pyrimidin-2-yl]pyrazole-4-carbonyl]isonipecotic acid ethyl ester Formula: C26H28FN5O4 MolecularWeight: 493.530023

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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(=C(C=C4)OC)F)C5CC5

Isomeric SMILES

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

InChI

InChI=1S/C26H28FN5O4/c1-3-36-25(34)17-9-12-31(13-10-17)24(33)19-15-29-32(23(19)16-4-5-16)26-28-11-8-21(30-26)18-6-7-22(35-2)20(27)14-18/h6-8,11,14-17H,3-5,9-10,12-13H2,1-2H3