1-[1-(4-fluorophenyl)-3-methyl-5-pyrrol-1-yl-pyrazol-4-yl]carbonylpiperidine-4-carboxamide

Systemtic Name: 1-[1-(4-fluorophenyl)-3-methyl-5-pyrrol-1-yl-pyrazol-4-yl]carbonylpiperidine-4-carboxamide Openeye Name: 1-[1-(4-fluorophenyl)-3-methyl-5-pyrrol-1-yl-pyrazole-4-carbonyl]piperidine-4-carboxamide CAS Name: 1-[[1-(4-fluorophenyl)-3-methyl-5-(1-pyrrolyl)-4-pyrazolyl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: 1-[1-(4-fluorophenyl)-3-methyl-5-pyrrol-1-ylpyrazole-4-carbonyl]piperidine-4-carboxamide Traditional Name: 1-[1-(4-fluorophenyl)-3-methyl-5-pyrrol-1-yl-pyrazole-4-carbonyl]isonipecotamide Formula: C21H22FN5O2 MolecularWeight: 395.430083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)N2CCC(CC2)C(=O)N)N3C=CC=C3)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=NN(C(=C1C(=O)N2CCC(CC2)C(=O)N)N3C=CC=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H22FN5O2/c1-14-18(21(29)26-12-8-15(9-13-26)19(23)28)20(25-10-2-3-11-25)27(24-14)17-6-4-16(22)5-7-17/h2-7,10-11,15H,8-9,12-13H2,1H3,(H2,23,28)