2-[bis(fluoranyl)methylsulfanyl]-N-[3-(4-pyridin-2-ylpiperazin-1-yl)sulfonylpropyl]benzamide

Systemtic Name: 2-[bis(fluoranyl)methylsulfanyl]-N-[3-(4-pyridin-2-ylpiperazin-1-yl)sulfonylpropyl]benzamide Openeye Name: 2-(difluoromethylsulfanyl)-N-[3-[4-(2-pyridyl)piperazin-1-yl]sulfonylpropyl]benzamide CAS Name: 2-(difluoromethylthio)-N-[3-[[4-(2-pyridinyl)-1-piperazinyl]sulfonyl]propyl]benzamide IUPAC Name: 2-(difluoromethylsulfanyl)-N-[3-(4-pyridin-2-ylpiperazin-1-yl)sulfonylpropyl]benzamide Traditional Name: 2-(difluoromethylthio)-N-[3-[4-(2-pyridyl)piperazino]sulfonylpropyl]benzamide Formula: C20H24F2N4O3S2 MolecularWeight: 470.556366

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)S(=O)(=O)CCCNC(=O)C3=CC=CC=C3SC(F)F

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)S(=O)(=O)CCCNC(=O)C3=CC=CC=C3SC(F)F

InChI

InChI=1S/C20H24F2N4O3S2/c21-20(22)30-17-7-2-1-6-16(17)19(27)24-10-5-15-31(28,29)26-13-11-25(12-14-26)18-8-3-4-9-23-18/h1-4,6-9,20H,5,10-15H2,(H,24,27)