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

Systemtic Name: 2-[(5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)carbonyl-methyl-amino]ethanoic acid Openeye Name: 2-[(5-chloro-2-methylsulfanyl-pyrimidine-4-carbonyl)-methyl-amino]acetic acid CAS Name: 2-[[[5-chloro-2-(methylthio)-4-pyrimidinyl]-oxomethyl]-methylamino]acetic acid IUPAC Name: 2-[(5-chloro-2-methylsulfanylpyrimidine-4-carbonyl)-methylamino]acetic acid Traditional Name: 2-[[5-chloro-2-(methylthio)pyrimidine-4-carbonyl]-methyl-amino]acetic acid Formula: C9H10ClN3O3S MolecularWeight: 275.712

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)O)C(=O)C1=NC(=NC=C1Cl)SC

Isomeric SMILES

CN(CC(=O)O)C(=O)C1=NC(=NC=C1Cl)SC

InChI

InChI=1S/C9H10ClN3O3S/c1-13(4-6(14)15)8(16)7-5(10)3-11-9(12-7)17-2/h3H,4H2,1-2H3,(H,14,15)