S-[(1-methylimidazol-2-yl)methyl] propanethioate

Systemtic Name: S-[(1-methylimidazol-2-yl)methyl] propanethioate Openeye Name: S-[(1-methylimidazol-2-yl)methyl] propanethioate CAS Name: propanethioic acid S-[(1-methyl-2-imidazolyl)methyl] ester IUPAC Name: S-[(1-methylimidazol-2-yl)methyl] propanethioate Traditional Name: propanethioic acid S-[(1-methylimidazol-2-yl)methyl] ester Formula: C8H12N2OS MolecularWeight: 184.25868

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)SCC1=NC=CN1C

Isomeric SMILES

CCC(=O)SCC1=NC=CN1C

InChI

InChI=1S/C8H12N2OS/c1-3-8(11)12-6-7-9-4-5-10(7)2/h4-5H,3,6H2,1-2H3