1-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-3-(3-ethanoylphenyl)thiourea

Systemtic Name: 1-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-3-(3-ethanoylphenyl)thiourea Openeye Name: 1-(3-acetylphenyl)-3-[4-(difluoromethylsulfanyl)phenyl]thiourea CAS Name: 1-(3-acetylphenyl)-3-[4-(difluoromethylthio)phenyl]thiourea IUPAC Name: 1-(3-acetylphenyl)-3-[4-(difluoromethylsulfanyl)phenyl]thiourea Traditional Name: 1-(3-acetylphenyl)-3-[4-(difluoromethylthio)phenyl]thiourea Formula: C16H14F2N2OS2 MolecularWeight: 352.421966

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=S)NC2=CC=C(C=C2)SC(F)F

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=S)NC2=CC=C(C=C2)SC(F)F

InChI

InChI=1S/C16H14F2N2OS2/c1-10(21)11-3-2-4-13(9-11)20-16(22)19-12-5-7-14(8-6-12)23-15(17)18/h2-9,15H,1H3,(H2,19,20,22)