methyl 3-[(5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)carbonylamino]propanoate

Systemtic Name: methyl 3-[(5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)carbonylamino]propanoate Openeye Name: methyl 3-[(5-chloro-2-methylsulfanyl-pyrimidine-4-carbonyl)amino]propanoate CAS Name: 3-[[[5-chloro-2-(methylthio)-4-pyrimidinyl]-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-[(5-chloro-2-methylsulfanylpyrimidine-4-carbonyl)amino]propanoate Traditional Name: 3-[[5-chloro-2-(methylthio)pyrimidine-4-carbonyl]amino]propionic acid methyl ester Formula: C10H12ClN3O3S MolecularWeight: 289.73858

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCNC(=O)C1=NC(=NC=C1Cl)SC

Isomeric SMILES

COC(=O)CCNC(=O)C1=NC(=NC=C1Cl)SC

InChI

InChI=1S/C10H12ClN3O3S/c1-17-7(15)3-4-12-9(16)8-6(11)5-13-10(14-8)18-2/h5H,3-4H2,1-2H3,(H,12,16)