2,4-dimethyl-6-(1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl)sulfanyl-pyrimidine-5-carboxylic acid

Systemtic Name: 2,4-dimethyl-6-(1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl)sulfanyl-pyrimidine-5-carboxylic acid Openeye Name: 2,4-dimethyl-6-(1-methyl-2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanyl-pyrimidine-5-carboxylic acid CAS Name: 2,4-dimethyl-6-[[1-oxo-1-(1-pyrrolidinyl)propan-2-yl]thio]-5-pyrimidinecarboxylic acid IUPAC Name: 2,4-dimethyl-6-(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)sulfanylpyrimidine-5-carboxylic acid Traditional Name: 4-[(2-keto-1-methyl-2-pyrrolidino-ethyl)thio]-2,6-dimethyl-pyrimidine-5-carboxylic acid Formula: C14H19N3O3S MolecularWeight: 309.38396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C)SC(C)C(=O)N2CCCC2)C(=O)O

Isomeric SMILES

CC1=C(C(=NC(=N1)C)SC(C)C(=O)N2CCCC2)C(=O)O

InChI

InChI=1S/C14H19N3O3S/c1-8-11(14(19)20)12(16-10(3)15-8)21-9(2)13(18)17-6-4-5-7-17/h9H,4-7H2,1-3H3,(H,19,20)