S-[(1,3,5-triethanoyl-2-oxidanylidene-imidazol-4-yl)methyl] ethanethioate

Systemtic Name: S-[(1,3,5-triethanoyl-2-oxidanylidene-imidazol-4-yl)methyl] ethanethioate Openeye Name: S-[(1,3,5-triacetyl-2-oxo-imidazol-4-yl)methyl] ethanethioate CAS Name: ethanethioic acid S-[(1,3,5-triacetyl-2-oxo-4-imidazolyl)methyl] ester IUPAC Name: S-[(1,3,5-triacetyl-2-oxoimidazol-4-yl)methyl] ethanethioate Traditional Name: ethanethioic acid S-[(1,3,5-triacetyl-2-keto-4-imidazolin-4-yl)methyl] ester Formula: C12H14N2O5S MolecularWeight: 298.31496

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(N(C(=O)N1C(=O)C)C(=O)C)CSC(=O)C

Isomeric SMILES

CC(=O)C1=C(N(C(=O)N1C(=O)C)C(=O)C)CSC(=O)C

InChI

InChI=1S/C12H14N2O5S/c1-6(15)11-10(5-20-9(4)18)13(7(2)16)12(19)14(11)8(3)17/h5H2,1-4H3