1-(5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)carbonylpyrrolidine-2-carboxylic acid

Systemtic Name: 1-(5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)carbonylpyrrolidine-2-carboxylic acid Openeye Name: 1-(5-chloro-2-methylsulfanyl-pyrimidine-4-carbonyl)pyrrolidine-2-carboxylic acid CAS Name: 1-[[5-chloro-2-(methylthio)-4-pyrimidinyl]-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(5-chloro-2-methylsulfanylpyrimidine-4-carbonyl)pyrrolidine-2-carboxylic acid Traditional Name: 1-[5-chloro-2-(methylthio)pyrimidine-4-carbonyl]proline Formula: C11H12ClN3O3S MolecularWeight: 301.74928

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)C(=O)N2CCCC2C(=O)O)Cl

Isomeric SMILES

CSC1=NC=C(C(=N1)C(=O)N2CCCC2C(=O)O)Cl

InChI

InChI=1S/C11H12ClN3O3S/c1-19-11-13-5-6(12)8(14-11)9(16)15-4-2-3-7(15)10(17)18/h5,7H,2-4H2,1H3,(H,17,18)