dimethyl (4R,29R)-6,27-bis(oxidanylidene)-1,2-dithia-5,28-diazacyclotriacontane-4,29-dicarboxylate

Systemtic Name: dimethyl (4R,29R)-6,27-bis(oxidanylidene)-1,2-dithia-5,28-diazacyclotriacontane-4,29-dicarboxylate Openeye Name: dimethyl (4R,29R)-6,27-dioxo-1,2-dithia-5,28-diazacyclotriacontane-4,29-dicarboxylate CAS Name: (4R,29R)-6,27-dioxo-1,2-dithia-5,28-diazacyclotriacontane-4,29-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (4R,29R)-6,27-dioxo-1,2-dithia-5,28-diazacyclotriacontane-4,29-dicarboxylate Traditional Name: (4R,29R)-6,27-diketo-1,2-dithia-5,28-diazacyclotriacontane-4,29-dicarboxylic acid dimethyl ester Formula: C30H54N2O6S2 MolecularWeight: 602.88956

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H54N2O6S2/c1-37-29(35)25-23-39-40-24-26(30(36)38-2)32-28(34)22-20-18-16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-19-21-27(33)31-25/h25-26H,3-24H2,1-2H3,(H,31,33)(H,32,34)/t25-,26-/m0/s1