methyl 2-[(6-methyl-4-methylsulfanyl-2-oxidanylidene-1H-pyrimidin-5-yl)carbonylamino]-3-oxidanyl-propanoate

Systemtic Name: methyl 2-[(6-methyl-4-methylsulfanyl-2-oxidanylidene-1H-pyrimidin-5-yl)carbonylamino]-3-oxidanyl-propanoate Openeye Name: methyl 3-hydroxy-2-[(6-methyl-4-methylsulfanyl-2-oxo-1H-pyrimidine-5-carbonyl)amino]propanoate CAS Name: 3-hydroxy-2-[[[6-methyl-4-(methylthio)-2-oxo-1H-pyrimidin-5-yl]-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-hydroxy-2-[(6-methyl-4-methylsulfanyl-2-oxo-1H-pyrimidine-5-carbonyl)amino]propanoate Traditional Name: 3-hydroxy-2-[[2-keto-6-methyl-4-(methylthio)-1H-pyrimidine-5-carbonyl]amino]propionic acid methyl ester Formula: C11H15N3O5S MolecularWeight: 301.3189

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=O)N1)SC)C(=O)NC(CO)C(=O)OC

Isomeric SMILES

CC1=C(C(=NC(=O)N1)SC)C(=O)NC(CO)C(=O)OC

InChI

InChI=1S/C11H15N3O5S/c1-5-7(9(20-3)14-11(18)12-5)8(16)13-6(4-15)10(17)19-2/h6,15H,4H2,1-3H3,(H,13,16)(H,12,14,18)