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

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-1-[1-(4-fluorophenyl)-5-pyrrol-1-yl-pyrazol-4-yl]carbonyl-piperidine-3-carboxamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-1-[1-(4-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carbonyl]piperidine-3-carboxamide CAS Name: N-(3-chloro-2-methylphenyl)-1-[[1-(4-fluorophenyl)-5-(1-pyrrolyl)-4-pyrazolyl]-oxomethyl]-3-piperidinecarboxamide IUPAC Name: N-(3-chloro-2-methylphenyl)-1-[1-(4-fluorophenyl)-5-pyrrol-1-ylpyrazole-4-carbonyl]piperidine-3-carboxamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-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:

CC1=C(C=CC=C1Cl)NC(=O)C2CCCN(C2)C(=O)C3=C(N(N=C3)C4=CC=C(C=C4)F)N5C=CC=C5

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)C2CCCN(C2)C(=O)C3=C(N(N=C3)C4=CC=C(C=C4)F)N5C=CC=C5

InChI

InChI=1S/C27H25ClFN5O2/c1-18-23(28)7-4-8-24(18)31-25(35)19-6-5-15-33(17-19)27(36)22-16-30-34(21-11-9-20(29)10-12-21)26(22)32-13-2-3-14-32/h2-4,7-14,16,19H,5-6,15,17H2,1H3,(H,31,35)