O-[(3-methyl-2H-imidazol-1-yl)methyl] ethanethioate chloride

Systemtic Name: O-[(3-methyl-2H-imidazol-1-yl)methyl] ethanethioate chloride Openeye Name: O-[(3-methyl-2H-imidazol-1-yl)methyl] ethanethioate chloride CAS Name: ethanethioic acid O-[(3-methyl-2H-imidazol-1-yl)methyl] ester chloride IUPAC Name: O-[(3-methyl-2H-imidazol-1-yl)methyl] ethanethioate chloride Traditional Name: ethanethioic acid O-[(3-methyl-4-imidazolin-1-yl)methyl] ester chloride Formula: C7H12ClN2OS- MolecularWeight: 207.70098

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Descriptors Computed from Structure

Canonical SMILES:

CC(=S)OCN1CN(C=C1)C.[Cl-]

Isomeric SMILES

CC(=S)OCN1CN(C=C1)C.[Cl-]

InChI

InChI=1S/C7H12N2OS.ClH/c1-7(11)10-6-9-4-3-8(2)5-9;/h3-4H,5-6H2,1-2H3;1H/p-1