2-[[2,3-bis(fluoranyl)phenyl]methylsulfanyl]-6-(furan-2-yl)-4-oxidanylidene-1H-pyrimidine-5-carbonitrile

Systemtic Name: 2-[[2,3-bis(fluoranyl)phenyl]methylsulfanyl]-6-(furan-2-yl)-4-oxidanylidene-1H-pyrimidine-5-carbonitrile Openeye Name: 2-[(2,3-difluorophenyl)methylsulfanyl]-6-(2-furyl)-4-oxo-1H-pyrimidine-5-carbonitrile CAS Name: 2-[(2,3-difluorophenyl)methylthio]-6-(2-furanyl)-4-oxo-1H-pyrimidine-5-carbonitrile IUPAC Name: 2-[(2,3-difluorophenyl)methylsulfanyl]-6-(furan-2-yl)-4-oxo-1H-pyrimidine-5-carbonitrile Traditional Name: 2-[(2,3-difluorobenzyl)thio]-6-(2-furyl)-4-keto-1H-pyrimidine-5-carbonitrile Formula: C16H9F2N3O2S MolecularWeight: 345.323366

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)F)F)CSC2=NC(=O)C(=C(N2)C3=CC=CO3)C#N

Isomeric SMILES

C1=CC(=C(C(=C1)F)F)CSC2=NC(=O)C(=C(N2)C3=CC=CO3)C#N

InChI

InChI=1S/C16H9F2N3O2S/c17-11-4-1-3-9(13(11)18)8-24-16-20-14(12-5-2-6-23-12)10(7-19)15(22)21-16/h1-6H,8H2,(H,20,21,22)