2-[(2,4-dimethyl-6-methylsulfanyl-pyrimidin-5-yl)carbonyl-methyl-amino]ethanoic acid

Systemtic Name: 2-[(2,4-dimethyl-6-methylsulfanyl-pyrimidin-5-yl)carbonyl-methyl-amino]ethanoic acid Openeye Name: 2-[(2,4-dimethyl-6-methylsulfanyl-pyrimidine-5-carbonyl)-methyl-amino]acetic acid CAS Name: 2-[[[2,4-dimethyl-6-(methylthio)-5-pyrimidinyl]-oxomethyl]-methylamino]acetic acid IUPAC Name: 2-[(2,4-dimethyl-6-methylsulfanylpyrimidine-5-carbonyl)-methylamino]acetic acid Traditional Name: 2-[[2,4-dimethyl-6-(methylthio)pyrimidine-5-carbonyl]-methyl-amino]acetic acid Formula: C11H15N3O3S MolecularWeight: 269.3201

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C)SC)C(=O)N(C)CC(=O)O

Isomeric SMILES

CC1=C(C(=NC(=N1)C)SC)C(=O)N(C)CC(=O)O

InChI

InChI=1S/C11H15N3O3S/c1-6-9(10(18-4)13-7(2)12-6)11(17)14(3)5-8(15)16/h5H2,1-4H3,(H,15,16)