2-[2-[(2-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-6-phenyl-pyrimidin-4-olate

Systemtic Name: 2-[2-[(2-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-6-phenyl-pyrimidin-4-olate Openeye Name: 2-[2-(2-fluoroanilino)-2-oxo-ethyl]sulfanyl-6-phenyl-pyrimidin-4-olate CAS Name: 2-[[2-(2-fluoroanilino)-2-oxoethyl]thio]-6-phenyl-4-pyrimidinolate IUPAC Name: 2-[2-(2-fluoroanilino)-2-oxoethyl]sulfanyl-6-phenylpyrimidin-4-olate Traditional Name: 2-[[2-(2-fluoroanilino)-2-keto-ethyl]thio]-6-phenyl-pyrimidin-4-olate Formula: C18H13FN3O2S- MolecularWeight: 354.378123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=NC(=N2)SCC(=O)NC3=CC=CC=C3F)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NC(=N2)SCC(=O)NC3=CC=CC=C3F)[O-]

InChI

InChI=1S/C18H14FN3O2S/c19-13-8-4-5-9-14(13)20-17(24)11-25-18-21-15(10-16(23)22-18)12-6-2-1-3-7-12/h1-10H,11H2,(H,20,24)(H,21,22,23)/p-1