2-[(6-methyl-4-methylsulfanyl-2-oxidanylidene-1H-pyrimidin-5-yl)carbonylamino]ethanoic acid

Systemtic Name: 2-[(6-methyl-4-methylsulfanyl-2-oxidanylidene-1H-pyrimidin-5-yl)carbonylamino]ethanoic acid Openeye Name: 2-[(6-methyl-4-methylsulfanyl-2-oxo-1H-pyrimidine-5-carbonyl)amino]acetic acid CAS Name: 2-[[[6-methyl-4-(methylthio)-2-oxo-1H-pyrimidin-5-yl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[(6-methyl-4-methylsulfanyl-2-oxo-1H-pyrimidine-5-carbonyl)amino]acetic acid Traditional Name: 2-[[2-keto-6-methyl-4-(methylthio)-1H-pyrimidine-5-carbonyl]amino]acetic acid Formula: C9H11N3O4S MolecularWeight: 257.26634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=O)N1)SC)C(=O)NCC(=O)O

Isomeric SMILES

CC1=C(C(=NC(=O)N1)SC)C(=O)NCC(=O)O

InChI

InChI=1S/C9H11N3O4S/c1-4-6(7(15)10-3-5(13)14)8(17-2)12-9(16)11-4/h3H2,1-2H3,(H,10,15)(H,13,14)(H,11,12,16)