tert-butyl 4-[4-(2-methylpyrimidin-4-yl)-3-phenyl-1H-pyrazol-5-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-(2-methylpyrimidin-4-yl)-3-phenyl-1H-pyrazol-5-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-(2-methylpyrimidin-4-yl)-3-phenyl-1H-pyrazol-5-yl]piperidine-1-carboxylate CAS Name: 4-[4-(2-methyl-4-pyrimidinyl)-3-phenyl-1H-pyrazol-5-yl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-(2-methylpyrimidin-4-yl)-3-phenyl-1H-pyrazol-5-yl]piperidine-1-carboxylate Traditional Name: 4-[4-(2-methylpyrimidin-4-yl)-3-phenyl-1H-pyrazol-5-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C24H29N5O2 MolecularWeight: 419.51936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CC(=N1)C2=C(NN=C2C3=CC=CC=C3)C4CCN(CC4)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=NC=CC(=N1)C2=C(NN=C2C3=CC=CC=C3)C4CCN(CC4)C(=O)OC(C)(C)C

InChI

InChI=1S/C24H29N5O2/c1-16-25-13-10-19(26-16)20-21(17-8-6-5-7-9-17)27-28-22(20)18-11-14-29(15-12-18)23(30)31-24(2,3)4/h5-10,13,18H,11-12,14-15H2,1-4H3,(H,27,28)