methyl 2-[2-[(2R)-1-(2,5-dimethylphenyl)-1-oxidanylidene-propan-2-yl]sulfanyl-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate

Systemtic Name: methyl 2-[2-[(2R)-1-(2,5-dimethylphenyl)-1-oxidanylidene-propan-2-yl]sulfanyl-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate Openeye Name: methyl 2-[2-[(1R)-2-(2,5-dimethylphenyl)-1-methyl-2-oxo-ethyl]sulfanyl-4-oxo-1H-pyrimidin-6-yl]acetate CAS Name: 2-[2-[[(2R)-1-(2,5-dimethylphenyl)-1-oxopropan-2-yl]thio]-4-oxo-1H-pyrimidin-6-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[(2R)-1-(2,5-dimethylphenyl)-1-oxopropan-2-yl]sulfanyl-4-oxo-1H-pyrimidin-6-yl]acetate Traditional Name: 2-[2-[[(1R)-2-(2,5-dimethylphenyl)-2-keto-1-methyl-ethyl]thio]-4-keto-1H-pyrimidin-6-yl]acetic acid methyl ester Formula: C18H20N2O4S MolecularWeight: 360.4274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(=O)C(C)SC2=NC(=O)C=C(N2)CC(=O)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(=O)[C@@H](C)SC2=NC(=O)C=C(N2)CC(=O)OC

InChI

InChI=1S/C18H20N2O4S/c1-10-5-6-11(2)14(7-10)17(23)12(3)25-18-19-13(8-15(21)20-18)9-16(22)24-4/h5-8,12H,9H2,1-4H3,(H,19,20,21)/t12-/m1/s1