2-[(5-chloranyl-1-methyl-imidazol-2-yl)methylsulfanyl]propanoic acid

Systemtic Name: 2-[(5-chloranyl-1-methyl-imidazol-2-yl)methylsulfanyl]propanoic acid Openeye Name: 2-[(5-chloro-1-methyl-imidazol-2-yl)methylsulfanyl]propanoic acid CAS Name: 2-[(5-chloro-1-methyl-2-imidazolyl)methylthio]propanoic acid IUPAC Name: 2-[(5-chloro-1-methylimidazol-2-yl)methylsulfanyl]propanoic acid Traditional Name: 2-[(5-chloro-1-methyl-imidazol-2-yl)methylthio]propionic acid Formula: C8H11ClN2O2S MolecularWeight: 234.70314

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SCC1=NC=C(N1C)Cl

Isomeric SMILES

CC(C(=O)O)SCC1=NC=C(N1C)Cl

InChI

InChI=1S/C8H11ClN2O2S/c1-5(8(12)13)14-4-7-10-3-6(9)11(7)2/h3,5H,4H2,1-2H3,(H,12,13)