2-[4-(4-fluorophenyl)-3-(4-methylsulfanylphenyl)-2,6-bis(oxidanylidene)pyrimidin-1-yl]ethanenitrile

Systemtic Name: 2-[4-(4-fluorophenyl)-3-(4-methylsulfanylphenyl)-2,6-bis(oxidanylidene)pyrimidin-1-yl]ethanenitrile Openeye Name: 2-[4-(4-fluorophenyl)-3-(4-methylsulfanylphenyl)-2,6-dioxo-pyrimidin-1-yl]acetonitrile CAS Name: 2-[4-(4-fluorophenyl)-3-[4-(methylthio)phenyl]-2,6-dioxo-1-pyrimidinyl]acetonitrile IUPAC Name: 2-[4-(4-fluorophenyl)-3-(4-methylsulfanylphenyl)-2,6-dioxopyrimidin-1-yl]acetonitrile Traditional Name: 2-[4-(4-fluorophenyl)-2,6-diketo-3-[4-(methylthio)phenyl]pyrimidin-1-yl]acetonitrile Formula: C19H14FN3O2S MolecularWeight: 367.396763

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)N2C(=CC(=O)N(C2=O)CC#N)C3=CC=C(C=C3)F

Isomeric SMILES

CSC1=CC=C(C=C1)N2C(=CC(=O)N(C2=O)CC#N)C3=CC=C(C=C3)F

InChI

InChI=1S/C19H14FN3O2S/c1-26-16-8-6-15(7-9-16)23-17(13-2-4-14(20)5-3-13)12-18(24)22(11-10-21)19(23)25/h2-9,12H,11H2,1H3