N1-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-N3-cyclopropyl-benzene-1,3-disulfonamide

Systemtic Name: N1-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-N3-cyclopropyl-benzene-1,3-disulfonamide Openeye Name: N3-cyclopropyl-N1-[4-(difluoromethylsulfanyl)phenyl]benzene-1,3-disulfonamide CAS Name: N3-cyclopropyl-N1-[4-(difluoromethylthio)phenyl]benzene-1,3-disulfonamide IUPAC Name: 3-N-cyclopropyl-1-N-[4-(difluoromethylsulfanyl)phenyl]benzene-1,3-disulfonamide Traditional Name: N'-cyclopropyl-N-[4-(difluoromethylthio)phenyl]benzene-1,3-disulfonamide Formula: C16H16F2N2O4S3 MolecularWeight: 434.501046

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NS(=O)(=O)C2=CC=CC(=C2)S(=O)(=O)NC3=CC=C(C=C3)SC(F)F

Isomeric SMILES

C1CC1NS(=O)(=O)C2=CC=CC(=C2)S(=O)(=O)NC3=CC=C(C=C3)SC(F)F

InChI

InChI=1S/C16H16F2N2O4S3/c17-16(18)25-13-8-6-12(7-9-13)20-27(23,24)15-3-1-2-14(10-15)26(21,22)19-11-4-5-11/h1-3,6-11,16,19-20H,4-5H2