methyl 3-[3-methyl-2-(2-oxidanylidenepropylsulfanyl)-2H-imidazol-1-yl]propanoate chloride

Systemtic Name: methyl 3-[3-methyl-2-(2-oxidanylidenepropylsulfanyl)-2H-imidazol-1-yl]propanoate chloride Openeye Name: methyl 3-(2-acetonylsulfanyl-3-methyl-2H-imidazol-1-yl)propanoate chloride CAS Name: 3-[3-methyl-2-(2-oxopropylthio)-2H-imidazol-1-yl]propanoic acid methyl ester chloride IUPAC Name: methyl 3-[3-methyl-2-(2-oxopropylsulfanyl)-2H-imidazol-1-yl]propanoate chloride Traditional Name: 3-[2-(acetonylthio)-3-methyl-4-imidazolin-1-yl]propionic acid methyl ester chloride Formula: C11H18ClN2O3S- MolecularWeight: 293.79022

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CSC1N(C=CN1CCC(=O)OC)C.[Cl-]

Isomeric SMILES

CC(=O)CSC1N(C=CN1CCC(=O)OC)C.[Cl-]

InChI

InChI=1S/C11H18N2O3S.ClH/c1-9(14)8-17-11-12(2)6-7-13(11)5-4-10(15)16-3;/h6-7,11H,4-5,8H2,1-3H3;1H/p-1