1-[(2,4-dimethyl-6-methylsulfanyl-pyrimidin-5-yl)carbonylamino]cyclopentane-1-carboxylic acid

Systemtic Name: 1-[(2,4-dimethyl-6-methylsulfanyl-pyrimidin-5-yl)carbonylamino]cyclopentane-1-carboxylic acid Openeye Name: 1-[(2,4-dimethyl-6-methylsulfanyl-pyrimidine-5-carbonyl)amino]cyclopentanecarboxylic acid CAS Name: 1-[[[2,4-dimethyl-6-(methylthio)-5-pyrimidinyl]-oxomethyl]amino]-1-cyclopentanecarboxylic acid IUPAC Name: 1-[(2,4-dimethyl-6-methylsulfanylpyrimidine-5-carbonyl)amino]cyclopentane-1-carboxylic acid Traditional Name: 1-[[2,4-dimethyl-6-(methylthio)pyrimidine-5-carbonyl]amino]cyclopentanecarboxylic acid Formula: C14H19N3O3S MolecularWeight: 309.38396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C)SC)C(=O)NC2(CCCC2)C(=O)O

Isomeric SMILES

CC1=C(C(=NC(=N1)C)SC)C(=O)NC2(CCCC2)C(=O)O

InChI

InChI=1S/C14H19N3O3S/c1-8-10(12(21-3)16-9(2)15-8)11(18)17-14(13(19)20)6-4-5-7-14/h4-7H2,1-3H3,(H,17,18)(H,19,20)