S-[2-(1H-imidazol-5-yl)ethyl] ethanethioate

Systemtic Name: S-[2-(1H-imidazol-5-yl)ethyl] ethanethioate Openeye Name: S-[2-(1H-imidazol-5-yl)ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-(1H-imidazol-5-yl)ethyl] ester IUPAC Name: S-[2-(1H-imidazol-5-yl)ethyl] ethanethioate Traditional Name: ethanethioic acid S-[2-(1H-imidazol-5-yl)ethyl] ester Formula: C7H10N2OS MolecularWeight: 170.2321

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCCC1=CN=CN1

Isomeric SMILES

CC(=O)SCCC1=CN=CN1

InChI

InChI=1S/C7H10N2OS/c1-6(10)11-3-2-7-4-8-5-9-7/h4-5H,2-3H2,1H3,(H,8,9)