4-azanyl-2-[[2-[bis(fluoranyl)methoxy]phenyl]methylsulfanyl]pyrimidine-5-carbonitrile

Systemtic Name: 4-azanyl-2-[[2-[bis(fluoranyl)methoxy]phenyl]methylsulfanyl]pyrimidine-5-carbonitrile Openeye Name: 4-amino-2-[[2-(difluoromethoxy)phenyl]methylsulfanyl]pyrimidine-5-carbonitrile CAS Name: 4-amino-2-[[2-(difluoromethoxy)phenyl]methylthio]-5-pyrimidinecarbonitrile IUPAC Name: 4-amino-2-[[2-(difluoromethoxy)phenyl]methylsulfanyl]pyrimidine-5-carbonitrile Traditional Name: 4-amino-2-[[2-(difluoromethoxy)benzyl]thio]pyrimidine-5-carbonitrile Formula: C13H10F2N4OS MolecularWeight: 308.306506

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10F2N4OS/c14-12(15)20-10-4-2-1-3-8(10)7-21-13-18-6-9(5-16)11(17)19-13/h1-4,6,12H,7H2,(H2,17,18,19)