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

Systemtic Name: tert-butyl 4-[4-(2-azanylpyrimidin-4-yl)-3-(4-chlorophenyl)-1H-pyrazol-5-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-(2-aminopyrimidin-4-yl)-3-(4-chlorophenyl)-1H-pyrazol-5-yl]piperidine-1-carboxylate CAS Name: 4-[4-(2-amino-4-pyrimidinyl)-3-(4-chlorophenyl)-1H-pyrazol-5-yl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-(2-aminopyrimidin-4-yl)-3-(4-chlorophenyl)-1H-pyrazol-5-yl]piperidine-1-carboxylate Traditional Name: 4-[4-(2-aminopyrimidin-4-yl)-3-(4-chlorophenyl)-1H-pyrazol-5-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C23H27ClN6O2 MolecularWeight: 454.95248

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C2=C(C(=NN2)C3=CC=C(C=C3)Cl)C4=NC(=NC=C4)N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C2=C(C(=NN2)C3=CC=C(C=C3)Cl)C4=NC(=NC=C4)N

InChI

InChI=1S/C23H27ClN6O2/c1-23(2,3)32-22(31)30-12-9-15(10-13-30)20-18(17-8-11-26-21(25)27-17)19(28-29-20)14-4-6-16(24)7-5-14/h4-8,11,15H,9-10,12-13H2,1-3H3,(H,28,29)(H2,25,26,27)