1-[2,4-bis(fluoranyl)phenyl]-5-piperidin-4-yl-N-(2-thiophen-3-ylethyl)pyrazole-4-carboxamide

Systemtic Name: 1-[2,4-bis(fluoranyl)phenyl]-5-piperidin-4-yl-N-(2-thiophen-3-ylethyl)pyrazole-4-carboxamide Openeye Name: 1-(2,4-difluorophenyl)-5-(4-piperidyl)-N-[2-(3-thienyl)ethyl]pyrazole-4-carboxamide CAS Name: 1-(2,4-difluorophenyl)-5-(4-piperidinyl)-N-[2-(3-thiophenyl)ethyl]-4-pyrazolecarboxamide IUPAC Name: 1-(2,4-difluorophenyl)-5-piperidin-4-yl-N-(2-thiophen-3-ylethyl)pyrazole-4-carboxamide Traditional Name: 1-(2,4-difluorophenyl)-5-(4-piperidyl)-N-[2-(3-thienyl)ethyl]pyrazole-4-carboxamide Formula: C21H22F2N4OS MolecularWeight: 416.487386

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C2=C(C=NN2C3=C(C=C(C=C3)F)F)C(=O)NCCC4=CSC=C4

Isomeric SMILES

C1CNCCC1C2=C(C=NN2C3=C(C=C(C=C3)F)F)C(=O)NCCC4=CSC=C4

InChI

InChI=1S/C21H22F2N4OS/c22-16-1-2-19(18(23)11-16)27-20(15-4-7-24-8-5-15)17(12-26-27)21(28)25-9-3-14-6-10-29-13-14/h1-2,6,10-13,15,24H,3-5,7-9H2,(H,25,28)