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

Systemtic Name: N-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-[4-(difluoromethylsulfanyl)phenyl]-3-(3-oxopiperazin-1-yl)sulfonyl-benzamide CAS Name: N-[4-(difluoromethylthio)phenyl]-3-[(3-oxo-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-[4-(difluoromethylsulfanyl)phenyl]-3-(3-oxopiperazin-1-yl)sulfonylbenzamide Traditional Name: N-[4-(difluoromethylthio)phenyl]-3-(3-ketopiperazino)sulfonyl-benzamide Formula: C18H17F2N3O4S2 MolecularWeight: 441.472086

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CC=C(C=C3)SC(F)F

Isomeric SMILES

C1CN(CC(=O)N1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CC=C(C=C3)SC(F)F

InChI

InChI=1S/C18H17F2N3O4S2/c19-18(20)28-14-6-4-13(5-7-14)22-17(25)12-2-1-3-15(10-12)29(26,27)23-9-8-21-16(24)11-23/h1-7,10,18H,8-9,11H2,(H,21,24)(H,22,25)