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

Systemtic Name: ethyl (2R)-1-[5-cyclopropyl-1-[4-(2,5-dimethylthiophen-3-yl)pyrimidin-2-yl]pyrazol-4-yl]carbonylpiperidine-2-carboxylate Openeye Name: ethyl (2R)-1-[5-cyclopropyl-1-[4-(2,5-dimethyl-3-thienyl)pyrimidin-2-yl]pyrazole-4-carbonyl]piperidine-2-carboxylate CAS Name: (2R)-1-[[5-cyclopropyl-1-[4-(2,5-dimethyl-3-thiophenyl)-2-pyrimidinyl]-4-pyrazolyl]-oxomethyl]-2-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (2R)-1-[5-cyclopropyl-1-[4-(2,5-dimethylthiophen-3-yl)pyrimidin-2-yl]pyrazole-4-carbonyl]piperidine-2-carboxylate Traditional Name: (2R)-1-[5-cyclopropyl-1-[4-(2,5-dimethyl-3-thienyl)pyrimidin-2-yl]pyrazole-4-carbonyl]pipecolinic acid ethyl ester Formula: C25H29N5O3S MolecularWeight: 479.59446

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCCN1C(=O)C2=C(N(N=C2)C3=NC=CC(=N3)C4=C(SC(=C4)C)C)C5CC5

Isomeric SMILES

CCOC(=O)[C@H]1CCCCN1C(=O)C2=C(N(N=C2)C3=NC=CC(=N3)C4=C(SC(=C4)C)C)C5CC5

InChI

InChI=1S/C25H29N5O3S/c1-4-33-24(32)21-7-5-6-12-29(21)23(31)19-14-27-30(22(19)17-8-9-17)25-26-11-10-20(28-25)18-13-15(2)34-16(18)3/h10-11,13-14,17,21H,4-9,12H2,1-3H3/t21-/m1/s1