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

Systemtic Name: methyl 6-(5-methoxy-5-oxidanylidene-pentyl)-2-sulfanylidene-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazole-3-carboxylate Openeye Name: methyl 6-(5-methoxy-5-oxo-pentyl)-2-thioxo-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazole-3-carboxylate CAS Name: 6-(5-methoxy-5-oxopentyl)-2-sulfanylidene-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazole-3-carboxylic acid methyl ester IUPAC Name: methyl 6-(5-methoxy-5-oxopentyl)-2-sulfanylidene-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazole-3-carboxylate Traditional Name: 6-(5-keto-5-methoxy-pentyl)-2-thioxo-3a,4,6,6a-tetrahydro-1H-thien[3,4-d]imidazole-3-carboxylic acid methyl ester Formula: C13H20N2O4S2 MolecularWeight: 332.4389

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCC1C2C(CS1)N(C(=S)N2)C(=O)OC

Isomeric SMILES

COC(=O)CCCCC1C2C(CS1)N(C(=S)N2)C(=O)OC

InChI

InChI=1S/C13H20N2O4S2/c1-18-10(16)6-4-3-5-9-11-8(7-21-9)15(12(20)14-11)13(17)19-2/h8-9,11H,3-7H2,1-2H3,(H,14,20)