1-[2-(2-chlorophenyl)-5-(1-methylpyrrol-2-yl)pyrazol-3-yl]carbonylpiperidine-4-carboxamide

Systemtic Name: 1-[2-(2-chlorophenyl)-5-(1-methylpyrrol-2-yl)pyrazol-3-yl]carbonylpiperidine-4-carboxamide Openeye Name: 1-[2-(2-chlorophenyl)-5-(1-methylpyrrol-2-yl)pyrazole-3-carbonyl]piperidine-4-carboxamide CAS Name: 1-[[2-(2-chlorophenyl)-5-(1-methyl-2-pyrrolyl)-3-pyrazolyl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-(2-chlorophenyl)-5-(1-methylpyrrol-2-yl)pyrazole-3-carbonyl]piperidine-4-carboxamide Traditional Name: 1-[2-(2-chlorophenyl)-5-(1-methylpyrrol-2-yl)pyrazole-3-carbonyl]isonipecotamide Formula: C21H22ClN5O2 MolecularWeight: 411.88468

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C2=NN(C(=C2)C(=O)N3CCC(CC3)C(=O)N)C4=CC=CC=C4Cl

Isomeric SMILES

CN1C=CC=C1C2=NN(C(=C2)C(=O)N3CCC(CC3)C(=O)N)C4=CC=CC=C4Cl

InChI

InChI=1S/C21H22ClN5O2/c1-25-10-4-7-18(25)16-13-19(27(24-16)17-6-3-2-5-15(17)22)21(29)26-11-8-14(9-12-26)20(23)28/h2-7,10,13-14H,8-9,11-12H2,1H3,(H2,23,28)