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

Systemtic Name: tert-butyl N-[4-[[3-(4-chlorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]methyl]cyclohexyl]carbamate Openeye Name: tert-butyl N-[4-[[3-(4-chlorophenyl)-4-(4-pyridyl)-1H-pyrazol-5-yl]methyl]cyclohexyl]carbamate CAS Name: N-[4-[[3-(4-chlorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]methyl]cyclohexyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[[3-(4-chlorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]methyl]cyclohexyl]carbamate Traditional Name: N-[4-[[3-(4-chlorophenyl)-4-(4-pyridyl)-1H-pyrazol-5-yl]methyl]cyclohexyl]carbamic acid tert-butyl ester Formula: C26H31ClN4O2 MolecularWeight: 467.00294

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CCC(CC1)CC2=C(C(=NN2)C3=CC=C(C=C3)Cl)C4=CC=NC=C4

Isomeric SMILES

CC(C)(C)OC(=O)NC1CCC(CC1)CC2=C(C(=NN2)C3=CC=C(C=C3)Cl)C4=CC=NC=C4

InChI

InChI=1S/C26H31ClN4O2/c1-26(2,3)33-25(32)29-21-10-4-17(5-11-21)16-22-23(18-12-14-28-15-13-18)24(31-30-22)19-6-8-20(27)9-7-19/h6-9,12-15,17,21H,4-5,10-11,16H2,1-3H3,(H,29,32)(H,30,31)