3-(2-methoxyphenyl)-N-[(1S,2S)-2-methylcyclohexyl]-1-(phenylmethyl)pyrazole-4-carboxamide

Systemtic Name: 3-(2-methoxyphenyl)-N-[(1S,2S)-2-methylcyclohexyl]-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-3-(2-methoxyphenyl)-N-[(1S,2S)-2-methylcyclohexyl]pyrazole-4-carboxamide CAS Name: 3-(2-methoxyphenyl)-N-[(1S,2S)-2-methylcyclohexyl]-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-3-(2-methoxyphenyl)-N-[(1S,2S)-2-methylcyclohexyl]pyrazole-4-carboxamide Traditional Name: 1-benzyl-3-(2-methoxyphenyl)-N-[(1S,2S)-2-methylcyclohexyl]pyrazole-4-carboxamide Formula: C25H29N3O2 MolecularWeight: 403.51666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)C2=CN(N=C2C3=CC=CC=C3OC)CC4=CC=CC=C4

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=O)C2=CN(N=C2C3=CC=CC=C3OC)CC4=CC=CC=C4

InChI

InChI=1S/C25H29N3O2/c1-18-10-6-8-14-22(18)26-25(29)21-17-28(16-19-11-4-3-5-12-19)27-24(21)20-13-7-9-15-23(20)30-2/h3-5,7,9,11-13,15,17-18,22H,6,8,10,14,16H2,1-2H3,(H,26,29)/t18-,22-/m0/s1