N-[2-[bis(fluoranyl)methylsulfanyl]phenyl]-2-morpholin-4-yl-5-nitro-benzamide

Systemtic Name: N-[2-[bis(fluoranyl)methylsulfanyl]phenyl]-2-morpholin-4-yl-5-nitro-benzamide Openeye Name: N-[2-(difluoromethylsulfanyl)phenyl]-2-morpholino-5-nitro-benzamide CAS Name: N-[2-(difluoromethylthio)phenyl]-2-(4-morpholinyl)-5-nitrobenzamide IUPAC Name: N-[2-(difluoromethylsulfanyl)phenyl]-2-morpholin-4-yl-5-nitrobenzamide Traditional Name: N-[2-(difluoromethylthio)phenyl]-2-morpholino-5-nitro-benzamide Formula: C18H17F2N3O4S MolecularWeight: 409.407086

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC=CC=C3SC(F)F

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC=CC=C3SC(F)F

InChI

InChI=1S/C18H17F2N3O4S/c19-18(20)28-16-4-2-1-3-14(16)21-17(24)13-11-12(23(25)26)5-6-15(13)22-7-9-27-10-8-22/h1-6,11,18H,7-10H2,(H,21,24)