1-[2-(3,4-dichlorophenyl)-5-(5-methylfuran-2-yl)pyrazol-3-yl]carbonylpiperidine-4-carboxamide

Systemtic Name: 1-[2-(3,4-dichlorophenyl)-5-(5-methylfuran-2-yl)pyrazol-3-yl]carbonylpiperidine-4-carboxamide Openeye Name: 1-[2-(3,4-dichlorophenyl)-5-(5-methyl-2-furyl)pyrazole-3-carbonyl]piperidine-4-carboxamide CAS Name: 1-[[2-(3,4-dichlorophenyl)-5-(5-methyl-2-furanyl)-3-pyrazolyl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-(3,4-dichlorophenyl)-5-(5-methylfuran-2-yl)pyrazole-3-carbonyl]piperidine-4-carboxamide Traditional Name: 1-[2-(3,4-dichlorophenyl)-5-(5-methyl-2-furyl)pyrazole-3-carbonyl]isonipecotamide Formula: C21H20Cl2N4O3 MolecularWeight: 447.3145

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C2=NN(C(=C2)C(=O)N3CCC(CC3)C(=O)N)C4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

CC1=CC=C(O1)C2=NN(C(=C2)C(=O)N3CCC(CC3)C(=O)N)C4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C21H20Cl2N4O3/c1-12-2-5-19(30-12)17-11-18(21(29)26-8-6-13(7-9-26)20(24)28)27(25-17)14-3-4-15(22)16(23)10-14/h2-5,10-11,13H,6-9H2,1H3,(H2,24,28)