methyl 2-[[2-(4,6-dimethoxypyrimidin-2-yl)sulfanylphenyl]carbonylamino]ethanoate

Systemtic Name: methyl 2-[[2-(4,6-dimethoxypyrimidin-2-yl)sulfanylphenyl]carbonylamino]ethanoate Openeye Name: methyl 2-[[2-(4,6-dimethoxypyrimidin-2-yl)sulfanylbenzoyl]amino]acetate CAS Name: 2-[[[2-[(4,6-dimethoxy-2-pyrimidinyl)thio]phenyl]-oxomethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[2-(4,6-dimethoxypyrimidin-2-yl)sulfanylbenzoyl]amino]acetate Traditional Name: 2-[[2-[(4,6-dimethoxypyrimidin-2-yl)thio]benzoyl]amino]acetic acid methyl ester Formula: C16H17N3O5S MolecularWeight: 363.38828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)SC2=CC=CC=C2C(=O)NCC(=O)OC)OC

Isomeric SMILES

COC1=CC(=NC(=N1)SC2=CC=CC=C2C(=O)NCC(=O)OC)OC

InChI

InChI=1S/C16H17N3O5S/c1-22-12-8-13(23-2)19-16(18-12)25-11-7-5-4-6-10(11)15(21)17-9-14(20)24-3/h4-8H,9H2,1-3H3,(H,17,21)