(phenylmethyl) 2-(1,4-dimethyl-6-oxidanylidene-pyrimidin-2-yl)sulfanylethanoate

Systemtic Name: (phenylmethyl) 2-(1,4-dimethyl-6-oxidanylidene-pyrimidin-2-yl)sulfanylethanoate Openeye Name: benzyl 2-(1,4-dimethyl-6-oxo-pyrimidin-2-yl)sulfanylacetate CAS Name: 2-[(1,4-dimethyl-6-oxo-2-pyrimidinyl)thio]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(1,4-dimethyl-6-oxopyrimidin-2-yl)sulfanylacetate Traditional Name: 2-[(6-keto-1,4-dimethyl-pyrimidin-2-yl)thio]acetic acid benzyl ester Formula: C15H16N2O3S MolecularWeight: 304.36414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C(=N1)SCC(=O)OCC2=CC=CC=C2)C

Isomeric SMILES

CC1=CC(=O)N(C(=N1)SCC(=O)OCC2=CC=CC=C2)C

InChI

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