methyl 2-[2-[4-(4-fluorophenyl)-4-oxidanylidene-butyl]sulfanyl-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate

Systemtic Name: methyl 2-[2-[4-(4-fluorophenyl)-4-oxidanylidene-butyl]sulfanyl-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate Openeye Name: methyl 2-[2-[4-(4-fluorophenyl)-4-oxo-butyl]sulfanyl-4-oxo-1H-pyrimidin-6-yl]acetate CAS Name: 2-[2-[[4-(4-fluorophenyl)-4-oxobutyl]thio]-4-oxo-1H-pyrimidin-6-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[4-(4-fluorophenyl)-4-oxobutyl]sulfanyl-4-oxo-1H-pyrimidin-6-yl]acetate Traditional Name: 2-[2-[[4-(4-fluorophenyl)-4-keto-butyl]thio]-4-keto-1H-pyrimidin-6-yl]acetic acid methyl ester Formula: C17H17FN2O4S MolecularWeight: 364.391283

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC(=O)N=C(N1)SCCCC(=O)C2=CC=C(C=C2)F

Isomeric SMILES

COC(=O)CC1=CC(=O)N=C(N1)SCCCC(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C17H17FN2O4S/c1-24-16(23)10-13-9-15(22)20-17(19-13)25-8-2-3-14(21)11-4-6-12(18)7-5-11/h4-7,9H,2-3,8,10H2,1H3,(H,19,20,22)