2-[(2-fluorophenyl)methylsulfanyl]-6-[2-oxidanylidene-2-(1,3-thiazol-2-ylamino)ethyl]pyrimidin-4-olate

Systemtic Name: 2-[(2-fluorophenyl)methylsulfanyl]-6-[2-oxidanylidene-2-(1,3-thiazol-2-ylamino)ethyl]pyrimidin-4-olate Openeye Name: 2-[(2-fluorophenyl)methylsulfanyl]-6-[2-oxo-2-(thiazol-2-ylamino)ethyl]pyrimidin-4-olate CAS Name: 2-[(2-fluorophenyl)methylthio]-6-[2-oxo-2-(2-thiazolylamino)ethyl]-4-pyrimidinolate IUPAC Name: 2-[(2-fluorophenyl)methylsulfanyl]-6-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]pyrimidin-4-olate Traditional Name: 2-[(2-fluorobenzyl)thio]-6-[2-keto-2-(thiazol-2-ylamino)ethyl]pyrimidin-4-olate Formula: C16H12FN4O2S2- MolecularWeight: 375.420483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSC2=NC(=CC(=N2)[O-])CC(=O)NC3=NC=CS3)F

Isomeric SMILES

C1=CC=C(C(=C1)CSC2=NC(=CC(=N2)[O-])CC(=O)NC3=NC=CS3)F

InChI

InChI=1S/C16H13FN4O2S2/c17-12-4-2-1-3-10(12)9-25-16-19-11(8-14(23)21-16)7-13(22)20-15-18-5-6-24-15/h1-6,8H,7,9H2,(H,18,20,22)(H,19,21,23)/p-1