N-[2-[1-[(3,5-dimethyl-4-oxidanyl-phenyl)methyl]piperidin-4-yl]pyrazol-3-yl]-2-phenyl-ethanamide

Systemtic Name: N-[2-[1-[(3,5-dimethyl-4-oxidanyl-phenyl)methyl]piperidin-4-yl]pyrazol-3-yl]-2-phenyl-ethanamide Openeye Name: N-[2-[1-[(4-hydroxy-3,5-dimethyl-phenyl)methyl]-4-piperidyl]pyrazol-3-yl]-2-phenyl-acetamide CAS Name: N-[2-[1-[(4-hydroxy-3,5-dimethylphenyl)methyl]-4-piperidinyl]-3-pyrazolyl]-2-phenylacetamide IUPAC Name: N-[2-[1-[(4-hydroxy-3,5-dimethylphenyl)methyl]piperidin-4-yl]pyrazol-3-yl]-2-phenylacetamide Traditional Name: N-[2-[1-(4-hydroxy-3,5-dimethyl-benzyl)-4-piperidyl]pyrazol-3-yl]-2-phenyl-acetamide Formula: C25H30N4O2 MolecularWeight: 418.5313

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O)C)CN2CCC(CC2)N3C(=CC=N3)NC(=O)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC(=C1O)C)CN2CCC(CC2)N3C(=CC=N3)NC(=O)CC4=CC=CC=C4

InChI

InChI=1S/C25H30N4O2/c1-18-14-21(15-19(2)25(18)31)17-28-12-9-22(10-13-28)29-23(8-11-26-29)27-24(30)16-20-6-4-3-5-7-20/h3-8,11,14-15,22,31H,9-10,12-13,16-17H2,1-2H3,(H,27,30)