1-[(2-chlorophenyl)methyl]-N-[(1R,2S)-2-methylcyclohexyl]pyrazole-4-carboxamide

Systemtic Name: 1-[(2-chlorophenyl)methyl]-N-[(1R,2S)-2-methylcyclohexyl]pyrazole-4-carboxamide Openeye Name: 1-[(2-chlorophenyl)methyl]-N-[(1R,2S)-2-methylcyclohexyl]pyrazole-4-carboxamide CAS Name: 1-[(2-chlorophenyl)methyl]-N-[(1R,2S)-2-methylcyclohexyl]-4-pyrazolecarboxamide IUPAC Name: 1-[(2-chlorophenyl)methyl]-N-[(1R,2S)-2-methylcyclohexyl]pyrazole-4-carboxamide Traditional Name: 1-(2-chlorobenzyl)-N-[(1R,2S)-2-methylcyclohexyl]pyrazole-4-carboxamide Formula: C18H22ClN3O MolecularWeight: 331.83978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)C2=CN(N=C2)CC3=CC=CC=C3Cl

Isomeric SMILES

C[C@H]1CCCC[C@H]1NC(=O)C2=CN(N=C2)CC3=CC=CC=C3Cl

InChI

InChI=1S/C18H22ClN3O/c1-13-6-2-5-9-17(13)21-18(23)15-10-20-22(12-15)11-14-7-3-4-8-16(14)19/h3-4,7-8,10,12-13,17H,2,5-6,9,11H2,1H3,(H,21,23)/t13-,17+/m0/s1