N-(3-chlorophenyl)-1-(3-methyl-1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-(3-chlorophenyl)-1-(3-methyl-1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)carbonyl-piperidine-4-carboxamide Openeye Name: N-(3-chlorophenyl)-1-(3-methyl-1-phenyl-5-pyrrol-1-yl-pyrazole-4-carbonyl)piperidine-4-carboxamide CAS Name: N-(3-chlorophenyl)-1-[[3-methyl-1-phenyl-5-(1-pyrrolyl)-4-pyrazolyl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-(3-chlorophenyl)-1-(3-methyl-1-phenyl-5-pyrrol-1-ylpyrazole-4-carbonyl)piperidine-4-carboxamide Traditional Name: N-(3-chlorophenyl)-1-(3-methyl-1-phenyl-5-pyrrol-1-yl-pyrazole-4-carbonyl)isonipecotamide Formula: C27H26ClN5O2 MolecularWeight: 487.98064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)N2CCC(CC2)C(=O)NC3=CC(=CC=C3)Cl)N4C=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C(=C1C(=O)N2CCC(CC2)C(=O)NC3=CC(=CC=C3)Cl)N4C=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H26ClN5O2/c1-19-24(26(31-14-5-6-15-31)33(30-19)23-10-3-2-4-11-23)27(35)32-16-12-20(13-17-32)25(34)29-22-9-7-8-21(28)18-22/h2-11,14-15,18,20H,12-13,16-17H2,1H3,(H,29,34)