2-[(5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)carbonylamino]-3-oxidanyl-butanoic acid

Systemtic Name: 2-[(5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)carbonylamino]-3-oxidanyl-butanoic acid Openeye Name: 2-[(5-chloro-2-methylsulfanyl-pyrimidine-4-carbonyl)amino]-3-hydroxy-butanoic acid CAS Name: 2-[[[5-chloro-2-(methylthio)-4-pyrimidinyl]-oxomethyl]amino]-3-hydroxybutanoic acid IUPAC Name: 2-[(5-chloro-2-methylsulfanylpyrimidine-4-carbonyl)amino]-3-hydroxybutanoic acid Traditional Name: 2-[[5-chloro-2-(methylthio)pyrimidine-4-carbonyl]amino]-3-hydroxy-butyric acid Formula: C10H12ClN3O4S MolecularWeight: 305.73798

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)O)NC(=O)C1=NC(=NC=C1Cl)SC)O

Isomeric SMILES

CC(C(C(=O)O)NC(=O)C1=NC(=NC=C1Cl)SC)O

InChI

InChI=1S/C10H12ClN3O4S/c1-4(15)6(9(17)18)13-8(16)7-5(11)3-12-10(14-7)19-2/h3-4,6,15H,1-2H3,(H,13,16)(H,17,18)