butyl 7-acetamido-6-oxidanylidene-1,2,5-dithiazocane-4-carboxylate

Systemtic Name: butyl 7-acetamido-6-oxidanylidene-1,2,5-dithiazocane-4-carboxylate Openeye Name: butyl 7-acetamido-6-oxo-1,2,5-dithiazocane-4-carboxylate CAS Name: 7-acetamido-6-oxo-1,2,5-dithiazocane-4-carboxylic acid butyl ester IUPAC Name: butyl 7-acetamido-6-oxo-1,2,5-dithiazocane-4-carboxylate Traditional Name: 7-acetamido-6-keto-1,2,5-dithiazocane-4-carboxylic acid butyl ester Formula: C12H20N2O4S2 MolecularWeight: 320.4282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1CSSCC(C(=O)N1)NC(=O)C

Isomeric SMILES

CCCCOC(=O)C1CSSCC(C(=O)N1)NC(=O)C

InChI

InChI=1S/C12H20N2O4S2/c1-3-4-5-18-12(17)10-7-20-19-6-9(11(16)14-10)13-8(2)15/h9-10H,3-7H2,1-2H3,(H,13,15)(H,14,16)