methyl 6-(5-acetyloxypentyl)-2-sulfanylidene-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazole-3-carboxylate

Systemtic Name: methyl 6-(5-acetyloxypentyl)-2-sulfanylidene-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazole-3-carboxylate Openeye Name: methyl 6-(5-acetoxypentyl)-2-thioxo-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazole-3-carboxylate CAS Name: 6-(5-acetyloxypentyl)-2-sulfanylidene-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazole-3-carboxylic acid methyl ester IUPAC Name: methyl 6-(5-acetyloxypentyl)-2-sulfanylidene-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazole-3-carboxylate Traditional Name: 6-(5-acetoxypentyl)-2-thioxo-3a,4,6,6a-tetrahydro-1H-thien[3,4-d]imidazole-3-carboxylic acid methyl ester Formula: C14H22N2O4S2 MolecularWeight: 346.46548

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCCCCC1C2C(CS1)N(C(=S)N2)C(=O)OC

Isomeric SMILES

CC(=O)OCCCCCC1C2C(CS1)N(C(=S)N2)C(=O)OC

InChI

InChI=1S/C14H22N2O4S2/c1-9(17)20-7-5-3-4-6-11-12-10(8-22-11)16(13(21)15-12)14(18)19-2/h10-12H,3-8H2,1-2H3,(H,15,21)