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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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