1-[1-(4-fluorophenyl)-5-pyrrol-1-yl-pyrazol-4-yl]carbonyl-N-[(2-methoxyphenyl)methyl]piperidine-3-carboxamide

Systemtic Name: 1-[1-(4-fluorophenyl)-5-pyrrol-1-yl-pyrazol-4-yl]carbonyl-N-[(2-methoxyphenyl)methyl]piperidine-3-carboxamide Openeye Name: 1-[1-(4-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carbonyl]-N-[(2-methoxyphenyl)methyl]piperidine-3-carboxamide CAS Name: 1-[[1-(4-fluorophenyl)-5-(1-pyrrolyl)-4-pyrazolyl]-oxomethyl]-N-[(2-methoxyphenyl)methyl]-3-piperidinecarboxamide IUPAC Name: 1-[1-(4-fluorophenyl)-5-pyrrol-1-ylpyrazole-4-carbonyl]-N-[(2-methoxyphenyl)methyl]piperidine-3-carboxamide Traditional Name: 1-[1-(4-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carbonyl]-N-o-anisyl-nipecotamide Formula: C28H28FN5O3 MolecularWeight: 501.552023

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CNC(=O)C2CCCN(C2)C(=O)C3=C(N(N=C3)C4=CC=C(C=C4)F)N5C=CC=C5

Isomeric SMILES

COC1=CC=CC=C1CNC(=O)C2CCCN(C2)C(=O)C3=C(N(N=C3)C4=CC=C(C=C4)F)N5C=CC=C5

InChI

InChI=1S/C28H28FN5O3/c1-37-25-9-3-2-7-20(25)17-30-26(35)21-8-6-16-33(19-21)28(36)24-18-31-34(23-12-10-22(29)11-13-23)27(24)32-14-4-5-15-32/h2-5,7,9-15,18,21H,6,8,16-17,19H2,1H3,(H,30,35)