methyl 2-[2-[(2-methylphenyl)methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate

Systemtic Name: methyl 2-[2-[(2-methylphenyl)methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate Openeye Name: methyl 2-[2-(o-tolylmethylsulfanyl)-4-oxo-1H-pyrimidin-6-yl]acetate CAS Name: 2-[2-[(2-methylphenyl)methylthio]-4-oxo-1H-pyrimidin-6-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[(2-methylphenyl)methylsulfanyl]-4-oxo-1H-pyrimidin-6-yl]acetate Traditional Name: 2-[4-keto-2-[(2-methylbenzyl)thio]-1H-pyrimidin-6-yl]acetic acid methyl ester Formula: C15H16N2O3S MolecularWeight: 304.36414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=NC(=O)C=C(N2)CC(=O)OC

Isomeric SMILES

CC1=CC=CC=C1CSC2=NC(=O)C=C(N2)CC(=O)OC

InChI

InChI=1S/C15H16N2O3S/c1-10-5-3-4-6-11(10)9-21-15-16-12(7-13(18)17-15)8-14(19)20-2/h3-7H,8-9H2,1-2H3,(H,16,17,18)