N-[2-[bis(fluoranyl)methylsulfanyl]phenyl]-3-(4-ethanoylpiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-[2-[bis(fluoranyl)methylsulfanyl]phenyl]-3-(4-ethanoylpiperazin-1-yl)sulfonyl-benzamide Openeye Name: 3-(4-acetylpiperazin-1-yl)sulfonyl-N-[2-(difluoromethylsulfanyl)phenyl]benzamide CAS Name: 3-[(4-acetyl-1-piperazinyl)sulfonyl]-N-[2-(difluoromethylthio)phenyl]benzamide IUPAC Name: 3-(4-acetylpiperazin-1-yl)sulfonyl-N-[2-(difluoromethylsulfanyl)phenyl]benzamide Traditional Name: 3-(4-acetylpiperazino)sulfonyl-N-[2-(difluoromethylthio)phenyl]benzamide Formula: C20H21F2N3O4S2 MolecularWeight: 469.525246

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CC=CC=C3SC(F)F

Isomeric SMILES

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CC=CC=C3SC(F)F

InChI

InChI=1S/C20H21F2N3O4S2/c1-14(26)24-9-11-25(12-10-24)31(28,29)16-6-4-5-15(13-16)19(27)23-17-7-2-3-8-18(17)30-20(21)22/h2-8,13,20H,9-12H2,1H3,(H,23,27)