tert-butyl 1-[2-[[1-ethoxy-3-(heptyldisulfanyl)-1-oxidanylidene-propan-2-yl]amino]propanoyl]pyrrolidine-2-carboxylate

Systemtic Name: tert-butyl 1-[2-[[1-ethoxy-3-(heptyldisulfanyl)-1-oxidanylidene-propan-2-yl]amino]propanoyl]pyrrolidine-2-carboxylate Openeye Name: tert-butyl 1-[2-[[2-ethoxy-1-[(heptyldisulfanyl)methyl]-2-oxo-ethyl]amino]propanoyl]pyrrolidine-2-carboxylate CAS Name: 1-[2-[[1-ethoxy-3-(heptyldisulfanyl)-1-oxopropan-2-yl]amino]-1-oxopropyl]-2-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-[2-[[1-ethoxy-3-(heptyldisulfanyl)-1-oxopropan-2-yl]amino]propanoyl]pyrrolidine-2-carboxylate Traditional Name: 1-[2-[[2-ethoxy-1-[(heptyldisulfanyl)methyl]-2-keto-ethyl]amino]propanoyl]pyrrolidine-2-carboxylic acid tert-butyl ester Formula: C24H44N2O5S2 MolecularWeight: 504.74656

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCSSCC(C(=O)OCC)NC(C)C(=O)N1CCCC1C(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCCSSCC(C(=O)OCC)NC(C)C(=O)N1CCCC1C(=O)OC(C)(C)C

InChI

InChI=1S/C24H44N2O5S2/c1-7-9-10-11-12-16-32-33-17-19(22(28)30-8-2)25-18(3)21(27)26-15-13-14-20(26)23(29)31-24(4,5)6/h18-20,25H,7-17H2,1-6H3