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

Systemtic Name: (phenylmethyl) 2-[(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanoate Openeye Name: benzyl 2-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]acetate CAS Name: 2-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)thio]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]acetate Traditional Name: 2-[(4-keto-6-methyl-1H-pyrimidin-2-yl)thio]acetic acid benzyl ester Formula: C14H14N2O3S MolecularWeight: 290.33756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H14N2O3S/c1-10-7-12(17)16-14(15-10)20-9-13(18)19-8-11-5-3-2-4-6-11/h2-7H,8-9H2,1H3,(H,15,16,17)