4,5-bis[(3-ethoxy-2-sulfanyl-butanoyl)amino]pentanoate

Systemtic Name: 4,5-bis[(3-ethoxy-2-sulfanyl-butanoyl)amino]pentanoate Openeye Name: 4,5-bis[(3-ethoxy-2-sulfanyl-butanoyl)amino]pentanoate CAS Name: 4,5-bis[(3-ethoxy-2-mercapto-1-oxobutyl)amino]pentanoate IUPAC Name: 4,5-bis[(3-ethoxy-2-sulfanylbutanoyl)amino]pentanoate Traditional Name: 4,5-bis[(3-ethoxy-2-mercapto-butanoyl)amino]valerate Formula: C17H31N2O6S2- MolecularWeight: 423.56784

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C)C(C(=O)NCC(CCC(=O)[O-])NC(=O)C(C(C)OCC)S)S

Isomeric SMILES

CCOC(C)C(C(=O)NCC(CCC(=O)[O-])NC(=O)C(C(C)OCC)S)S

InChI

InChI=1S/C17H32N2O6S2/c1-5-24-10(3)14(26)16(22)18-9-12(7-8-13(20)21)19-17(23)15(27)11(4)25-6-2/h10-12,14-15,26-27H,5-9H2,1-4H3,(H,18,22)(H,19,23)(H,20,21)/p-1