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

Systemtic Name: methyl 2-[2-[1-[(4-fluorophenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanyl-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate Openeye Name: methyl 2-[2-[2-(4-fluoroanilino)-1-methyl-2-oxo-ethyl]sulfanyl-4-oxo-1H-pyrimidin-6-yl]acetate CAS Name: 2-[2-[[1-(4-fluoroanilino)-1-oxopropan-2-yl]thio]-4-oxo-1H-pyrimidin-6-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[1-(4-fluoroanilino)-1-oxopropan-2-yl]sulfanyl-4-oxo-1H-pyrimidin-6-yl]acetate Traditional Name: 2-[2-[[2-(4-fluoroanilino)-2-keto-1-methyl-ethyl]thio]-4-keto-1H-pyrimidin-6-yl]acetic acid methyl ester Formula: C16H16FN3O4S MolecularWeight: 365.379343

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)F)SC2=NC(=O)C=C(N2)CC(=O)OC

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)F)SC2=NC(=O)C=C(N2)CC(=O)OC

InChI

InChI=1S/C16H16FN3O4S/c1-9(15(23)18-11-5-3-10(17)4-6-11)25-16-19-12(7-13(21)20-16)8-14(22)24-2/h3-7,9H,8H2,1-2H3,(H,18,23)(H,19,20,21)