3-(4-fluorophenyl)-2-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]sulfanyl-6-oxidanylidene-pyrimidin-4-olate

Systemtic Name: 3-(4-fluorophenyl)-2-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]sulfanyl-6-oxidanylidene-pyrimidin-4-olate Openeye Name: 3-(4-fluorophenyl)-2-[2-(2-furylmethylamino)-2-oxo-ethyl]sulfanyl-6-oxo-pyrimidin-4-olate CAS Name: 3-(4-fluorophenyl)-2-[[2-(2-furanylmethylamino)-2-oxoethyl]thio]-6-oxo-4-pyrimidinolate IUPAC Name: 3-(4-fluorophenyl)-2-[2-(furan-2-ylmethylamino)-2-oxoethyl]sulfanyl-6-oxopyrimidin-4-olate Traditional Name: 3-(4-fluorophenyl)-2-[[2-(2-furfurylamino)-2-keto-ethyl]thio]-6-keto-pyrimidin-4-olate Formula: C17H13FN3O4S- MolecularWeight: 374.366223

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CNC(=O)CSC2=NC(=O)C=C(N2C3=CC=C(C=C3)F)[O-]

Isomeric SMILES

C1=COC(=C1)CNC(=O)CSC2=NC(=O)C=C(N2C3=CC=C(C=C3)F)[O-]

InChI

InChI=1S/C17H14FN3O4S/c18-11-3-5-12(6-4-11)21-16(24)8-14(22)20-17(21)26-10-15(23)19-9-13-2-1-7-25-13/h1-8,24H,9-10H2,(H,19,23)/p-1