dimethyl (4R,13R)-6,11-bis(oxidanylidene)-1,2-dithia-5,12-diazacyclotetradecane-4,13-dicarboxylate

Systemtic Name: dimethyl (4R,13R)-6,11-bis(oxidanylidene)-1,2-dithia-5,12-diazacyclotetradecane-4,13-dicarboxylate Openeye Name: dimethyl (4R,13R)-6,11-dioxo-1,2-dithia-5,12-diazacyclotetradecane-4,13-dicarboxylate CAS Name: (4R,13R)-6,11-dioxo-1,2-dithia-5,12-diazacyclotetradecane-4,13-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (4R,13R)-6,11-dioxo-1,2-dithia-5,12-diazacyclotetradecane-4,13-dicarboxylate Traditional Name: (4R,13R)-6,11-diketo-1,2-dithia-5,12-diazacyclotetradecane-4,13-dicarboxylic acid dimethyl ester Formula: C14H22N2O6S2 MolecularWeight: 378.46428

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CSSCC(NC(=O)CCCCC(=O)N1)C(=O)OC

Isomeric SMILES

COC(=O)[C@@H]1CSSC[C@H](NC(=O)CCCCC(=O)N1)C(=O)OC

InChI

InChI=1S/C14H22N2O6S2/c1-21-13(19)9-7-23-24-8-10(14(20)22-2)16-12(18)6-4-3-5-11(17)15-9/h9-10H,3-8H2,1-2H3,(H,15,17)(H,16,18)/t9-,10-/m0/s1