3-[2-carboxyethyl(dodecylcarbamothioyl)amino]propanoic acid

Systemtic Name: 3-[2-carboxyethyl(dodecylcarbamothioyl)amino]propanoic acid Openeye Name: 3-[2-carboxyethyl(dodecylcarbamothioyl)amino]propanoic acid CAS Name: 3-[2-carboxyethyl-[(dodecylamino)-sulfanylidenemethyl]amino]propanoic acid IUPAC Name: 3-[2-carboxyethyl(dodecylcarbamothioyl)amino]propanoic acid Traditional Name: 3-[2-carboxyethyl(laurylthiocarbamoyl)amino]propionic acid Formula: C19H36N2O4S MolecularWeight: 388.56514

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCNC(=S)N(CCC(=O)O)CCC(=O)O

Isomeric SMILES

CCCCCCCCCCCCNC(=S)N(CCC(=O)O)CCC(=O)O

InChI

InChI=1S/C19H36N2O4S/c1-2-3-4-5-6-7-8-9-10-11-14-20-19(26)21(15-12-17(22)23)16-13-18(24)25/h2-16H2,1H3,(H,20,26)(H,22,23)(H,24,25)