tert-butyl N-[4-[3-(4-chlorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]cyclohexyl]carbamate

Systemtic Name: tert-butyl N-[4-[3-(4-chlorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]cyclohexyl]carbamate Openeye Name: tert-butyl N-[4-[3-(4-chlorophenyl)-4-(4-pyridyl)-1H-pyrazol-5-yl]cyclohexyl]carbamate CAS Name: N-[4-[3-(4-chlorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]cyclohexyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[3-(4-chlorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]cyclohexyl]carbamate Traditional Name: N-[4-[3-(4-chlorophenyl)-4-(4-pyridyl)-1H-pyrazol-5-yl]cyclohexyl]carbamic acid tert-butyl ester Formula: C25H29ClN4O2 MolecularWeight: 452.97636

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CCC(CC1)C2=C(C(=NN2)C3=CC=C(C=C3)Cl)C4=CC=NC=C4

Isomeric SMILES

CC(C)(C)OC(=O)NC1CCC(CC1)C2=C(C(=NN2)C3=CC=C(C=C3)Cl)C4=CC=NC=C4

InChI

InChI=1S/C25H29ClN4O2/c1-25(2,3)32-24(31)28-20-10-6-18(7-11-20)23-21(16-12-14-27-15-13-16)22(29-30-23)17-4-8-19(26)9-5-17/h4-5,8-9,12-15,18,20H,6-7,10-11H2,1-3H3,(H,28,31)(H,29,30)