methyl 2-[[6-methyl-4-oxidanylidene-5-(phenylmethyl)-1H-pyrimidin-2-yl]sulfanyl]ethanoate

Systemtic Name: methyl 2-[[6-methyl-4-oxidanylidene-5-(phenylmethyl)-1H-pyrimidin-2-yl]sulfanyl]ethanoate Openeye Name: methyl 2-[(5-benzyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]acetate CAS Name: 2-[[6-methyl-4-oxo-5-(phenylmethyl)-1H-pyrimidin-2-yl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[(5-benzyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]acetate Traditional Name: 2-[(5-benzyl-4-keto-6-methyl-1H-pyrimidin-2-yl)thio]acetic acid methyl ester Formula: C15H16N2O3S MolecularWeight: 304.36414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SCC(=O)OC)CC2=CC=CC=C2

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SCC(=O)OC)CC2=CC=CC=C2

InChI

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