1-[1-(4-fluorophenyl)-5-pyrrol-1-yl-pyrazol-4-yl]carbonyl-N-[(4-methylphenyl)methyl]piperidine-3-carboxamide

Systemtic Name: 1-[1-(4-fluorophenyl)-5-pyrrol-1-yl-pyrazol-4-yl]carbonyl-N-[(4-methylphenyl)methyl]piperidine-3-carboxamide Openeye Name: 1-[1-(4-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carbonyl]-N-(p-tolylmethyl)piperidine-3-carboxamide CAS Name: 1-[[1-(4-fluorophenyl)-5-(1-pyrrolyl)-4-pyrazolyl]-oxomethyl]-N-[(4-methylphenyl)methyl]-3-piperidinecarboxamide IUPAC Name: 1-[1-(4-fluorophenyl)-5-pyrrol-1-ylpyrazole-4-carbonyl]-N-[(4-methylphenyl)methyl]piperidine-3-carboxamide Traditional Name: 1-[1-(4-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carbonyl]-N-(4-methylbenzyl)nipecotamide Formula: C28H28FN5O2 MolecularWeight: 485.552623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2CCCN(C2)C(=O)C3=C(N(N=C3)C4=CC=C(C=C4)F)N5C=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2CCCN(C2)C(=O)C3=C(N(N=C3)C4=CC=C(C=C4)F)N5C=CC=C5

InChI

InChI=1S/C28H28FN5O2/c1-20-6-8-21(9-7-20)17-30-26(35)22-5-4-16-33(19-22)28(36)25-18-31-34(24-12-10-23(29)11-13-24)27(25)32-14-2-3-15-32/h2-3,6-15,18,22H,4-5,16-17,19H2,1H3,(H,30,35)