N-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-3-(3-bromanyl-4-methoxy-phenyl)propanamide

Systemtic Name: N-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-3-(3-bromanyl-4-methoxy-phenyl)propanamide Openeye Name: 3-(3-bromo-4-methoxy-phenyl)-N-[4-(difluoromethylsulfanyl)phenyl]propanamide CAS Name: 3-(3-bromo-4-methoxyphenyl)-N-[4-(difluoromethylthio)phenyl]propanamide IUPAC Name: 3-(3-bromo-4-methoxyphenyl)-N-[4-(difluoromethylsulfanyl)phenyl]propanamide Traditional Name: 3-(3-bromo-4-methoxy-phenyl)-N-[4-(difluoromethylthio)phenyl]propionamide Formula: C17H16BrF2NO2S MolecularWeight: 416.280246

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCC(=O)NC2=CC=C(C=C2)SC(F)F)Br

Isomeric SMILES

COC1=C(C=C(C=C1)CCC(=O)NC2=CC=C(C=C2)SC(F)F)Br

InChI

InChI=1S/C17H16BrF2NO2S/c1-23-15-8-2-11(10-14(15)18)3-9-16(22)21-12-4-6-13(7-5-12)24-17(19)20/h2,4-8,10,17H,3,9H2,1H3,(H,21,22)