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

Systemtic Name: 1-[1-(4-fluorophenyl)-5-thiophen-2-yl-pyrazol-3-yl]carbonyl-N-methyl-piperidine-4-carboxamide Openeye Name: 1-[1-(4-fluorophenyl)-5-(2-thienyl)pyrazole-3-carbonyl]-N-methyl-piperidine-4-carboxamide CAS Name: 1-[[1-(4-fluorophenyl)-5-thiophen-2-yl-3-pyrazolyl]-oxomethyl]-N-methyl-4-piperidinecarboxamide IUPAC Name: 1-[1-(4-fluorophenyl)-5-thiophen-2-ylpyrazole-3-carbonyl]-N-methylpiperidine-4-carboxamide Traditional Name: 1-[1-(4-fluorophenyl)-5-(2-thienyl)pyrazole-3-carbonyl]-N-methyl-isonipecotamide Formula: C21H21FN4O2S MolecularWeight: 412.480443

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1CCN(CC1)C(=O)C2=NN(C(=C2)C3=CC=CS3)C4=CC=C(C=C4)F

Isomeric SMILES

CNC(=O)C1CCN(CC1)C(=O)C2=NN(C(=C2)C3=CC=CS3)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H21FN4O2S/c1-23-20(27)14-8-10-25(11-9-14)21(28)17-13-18(19-3-2-12-29-19)26(24-17)16-6-4-15(22)5-7-16/h2-7,12-14H,8-11H2,1H3,(H,23,27)