6-azanyl-2-[2-[4-[bis(fluoranyl)methoxy]phenyl]-2-oxidanylidene-ethyl]sulfanyl-1H-pyrimidin-4-one

Systemtic Name: 6-azanyl-2-[2-[4-[bis(fluoranyl)methoxy]phenyl]-2-oxidanylidene-ethyl]sulfanyl-1H-pyrimidin-4-one Openeye Name: 6-amino-2-[2-[4-(difluoromethoxy)phenyl]-2-oxo-ethyl]sulfanyl-1H-pyrimidin-4-one CAS Name: 6-amino-2-[[2-[4-(difluoromethoxy)phenyl]-2-oxoethyl]thio]-1H-pyrimidin-4-one IUPAC Name: 6-amino-2-[2-[4-(difluoromethoxy)phenyl]-2-oxoethyl]sulfanyl-1H-pyrimidin-4-one Traditional Name: 6-amino-2-[[2-[4-(difluoromethoxy)phenyl]-2-keto-ethyl]thio]-1H-pyrimidin-4-one Formula: C13H11F2N3O3S MolecularWeight: 327.306546

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)CSC2=NC(=O)C=C(N2)N)OC(F)F

Isomeric SMILES

C1=CC(=CC=C1C(=O)CSC2=NC(=O)C=C(N2)N)OC(F)F

InChI

InChI=1S/C13H11F2N3O3S/c14-12(15)21-8-3-1-7(2-4-8)9(19)6-22-13-17-10(16)5-11(20)18-13/h1-5,12H,6H2,(H3,16,17,18,20)