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

Systemtic Name: N-[(2-chlorophenyl)methyl]-1-[1-(4-fluorophenyl)-5-pyrrol-1-yl-pyrazol-4-yl]carbonyl-piperidine-3-carboxamide Openeye Name: N-[(2-chlorophenyl)methyl]-1-[1-(4-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carbonyl]piperidine-3-carboxamide CAS Name: N-[(2-chlorophenyl)methyl]-1-[[1-(4-fluorophenyl)-5-(1-pyrrolyl)-4-pyrazolyl]-oxomethyl]-3-piperidinecarboxamide IUPAC Name: N-[(2-chlorophenyl)methyl]-1-[1-(4-fluorophenyl)-5-pyrrol-1-ylpyrazole-4-carbonyl]piperidine-3-carboxamide Traditional Name: N-(2-chlorobenzyl)-1-[1-(4-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carbonyl]nipecotamide Formula: C27H25ClFN5O2 MolecularWeight: 505.971103

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=C(N(N=C2)C3=CC=C(C=C3)F)N4C=CC=C4)C(=O)NCC5=CC=CC=C5Cl

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=C(N(N=C2)C3=CC=C(C=C3)F)N4C=CC=C4)C(=O)NCC5=CC=CC=C5Cl

InChI

InChI=1S/C27H25ClFN5O2/c28-24-8-2-1-6-19(24)16-30-25(35)20-7-5-15-33(18-20)27(36)23-17-31-34(22-11-9-21(29)10-12-22)26(23)32-13-3-4-14-32/h1-4,6,8-14,17,20H,5,7,15-16,18H2,(H,30,35)