N-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-4-morpholin-4-yl-3-nitro-benzamide

Systemtic Name: N-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-4-morpholin-4-yl-3-nitro-benzamide Openeye Name: N-[4-(difluoromethylsulfanyl)phenyl]-4-morpholino-3-nitro-benzamide CAS Name: N-[4-(difluoromethylthio)phenyl]-4-(4-morpholinyl)-3-nitrobenzamide IUPAC Name: N-[4-(difluoromethylsulfanyl)phenyl]-4-morpholin-4-yl-3-nitrobenzamide Traditional Name: N-[4-(difluoromethylthio)phenyl]-4-morpholino-3-nitro-benzamide Formula: C18H17F2N3O4S MolecularWeight: 409.407086

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)SC(F)F)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)SC(F)F)[N+](=O)[O-]

InChI

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