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

Systemtic Name: 2-[[2,3-bis(fluoranyl)phenyl]methylsulfanyl]-6-(3-hydroxyphenyl)-4-oxidanylidene-1H-pyrimidine-5-carbonitrile Openeye Name: 2-[(2,3-difluorophenyl)methylsulfanyl]-6-(3-hydroxyphenyl)-4-oxo-1H-pyrimidine-5-carbonitrile CAS Name: 2-[(2,3-difluorophenyl)methylthio]-6-(3-hydroxyphenyl)-4-oxo-1H-pyrimidine-5-carbonitrile IUPAC Name: 2-[(2,3-difluorophenyl)methylsulfanyl]-6-(3-hydroxyphenyl)-4-oxo-1H-pyrimidine-5-carbonitrile Traditional Name: 2-[(2,3-difluorobenzyl)thio]-6-(3-hydroxyphenyl)-4-keto-1H-pyrimidine-5-carbonitrile Formula: C18H11F2N3O2S MolecularWeight: 371.360646

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)O)C2=C(C(=O)N=C(N2)SCC3=C(C(=CC=C3)F)F)C#N

Isomeric SMILES

C1=CC(=CC(=C1)O)C2=C(C(=O)N=C(N2)SCC3=C(C(=CC=C3)F)F)C#N

InChI

InChI=1S/C18H11F2N3O2S/c19-14-6-2-4-11(15(14)20)9-26-18-22-16(13(8-21)17(25)23-18)10-3-1-5-12(24)7-10/h1-7,24H,9H2,(H,22,23,25)