1-[(6-methyl-4-methylsulfanyl-2-oxidanylidene-1H-pyrimidin-5-yl)carbonyl]-4-oxidanyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(6-methyl-4-methylsulfanyl-2-oxidanylidene-1H-pyrimidin-5-yl)carbonyl]-4-oxidanyl-pyrrolidine-2-carboxylic acid Openeye Name: 4-hydroxy-1-(6-methyl-4-methylsulfanyl-2-oxo-1H-pyrimidine-5-carbonyl)pyrrolidine-2-carboxylic acid CAS Name: 4-hydroxy-1-[[6-methyl-4-(methylthio)-2-oxo-1H-pyrimidin-5-yl]-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 4-hydroxy-1-(6-methyl-4-methylsulfanyl-2-oxo-1H-pyrimidine-5-carbonyl)pyrrolidine-2-carboxylic acid Traditional Name: 4-hydroxy-1-[2-keto-6-methyl-4-(methylthio)-1H-pyrimidine-5-carbonyl]proline Formula: C12H15N3O5S MolecularWeight: 313.3296

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=O)N1)SC)C(=O)N2CC(CC2C(=O)O)O

Isomeric SMILES

CC1=C(C(=NC(=O)N1)SC)C(=O)N2CC(CC2C(=O)O)O

InChI

InChI=1S/C12H15N3O5S/c1-5-8(9(21-2)14-12(20)13-5)10(17)15-4-6(16)3-7(15)11(18)19/h6-7,16H,3-4H2,1-2H3,(H,18,19)(H,13,14,20)