(phenylmethyl) 2-(dibutoxymethyl)-1-pyrrolidin-2-ylcarbonyl-3,4-bis(sulfanylidene)pyrrolidine-2-carboxylate

Systemtic Name: (phenylmethyl) 2-(dibutoxymethyl)-1-pyrrolidin-2-ylcarbonyl-3,4-bis(sulfanylidene)pyrrolidine-2-carboxylate Openeye Name: benzyl 2-(dibutoxymethyl)-1-(pyrrolidine-2-carbonyl)-3,4-dithioxo-pyrrolidine-2-carboxylate CAS Name: 2-(dibutoxymethyl)-1-[oxo(2-pyrrolidinyl)methyl]-3,4-bis(sulfanylidene)-2-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(dibutoxymethyl)-1-(pyrrolidine-2-carbonyl)-3,4-bis(sulfanylidene)pyrrolidine-2-carboxylate Traditional Name: 2-(dibutoxymethyl)-1-prolyl-3,4-dithioxo-pyrrolidine-2-carboxylic acid benzyl ester Formula: C26H36N2O5S2 MolecularWeight: 520.70444

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(C1(C(=S)C(=S)CN1C(=O)C2CCCN2)C(=O)OCC3=CC=CC=C3)OCCCC

Isomeric SMILES

CCCCOC(C1(C(=S)C(=S)CN1C(=O)C2CCCN2)C(=O)OCC3=CC=CC=C3)OCCCC

InChI

InChI=1S/C26H36N2O5S2/c1-3-5-15-31-25(32-16-6-4-2)26(24(30)33-18-19-11-8-7-9-12-19)22(35)21(34)17-28(26)23(29)20-13-10-14-27-20/h7-9,11-12,20,25,27H,3-6,10,13-18H2,1-2H3