2-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-3-(2-fluorophenyl)-6-oxidanylidene-pyrimidin-4-olate

Systemtic Name: 2-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-3-(2-fluorophenyl)-6-oxidanylidene-pyrimidin-4-olate Openeye Name: 2-(2-amino-2-oxo-ethyl)sulfanyl-3-(2-fluorophenyl)-6-oxo-pyrimidin-4-olate CAS Name: 2-[(2-amino-2-oxoethyl)thio]-3-(2-fluorophenyl)-6-oxo-4-pyrimidinolate IUPAC Name: 2-(2-amino-2-oxoethyl)sulfanyl-3-(2-fluorophenyl)-6-oxopyrimidin-4-olate Traditional Name: 2-[(2-amino-2-keto-ethyl)thio]-3-(2-fluorophenyl)-6-keto-pyrimidin-4-olate Formula: C12H9FN3O3S- MolecularWeight: 294.281563

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)N2C(=CC(=O)N=C2SCC(=O)N)[O-])F

Isomeric SMILES

C1=CC=C(C(=C1)N2C(=CC(=O)N=C2SCC(=O)N)[O-])F

InChI

InChI=1S/C12H10FN3O3S/c13-7-3-1-2-4-8(7)16-11(19)5-10(18)15-12(16)20-6-9(14)17/h1-5,19H,6H2,(H2,14,17)/p-1