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

Systemtic Name: 3-[2-carboxyethyl(dodecylsulfanylcarbothioyl)amino]propanoic acid Openeye Name: 3-[2-carboxyethyl(dodecylsulfanylcarbothioyl)amino]propanoic acid CAS Name: 3-[2-carboxyethyl-[(dodecylthio)-sulfanylidenemethyl]amino]propanoic acid IUPAC Name: 3-[2-carboxyethyl(dodecylsulfanylcarbothioyl)amino]propanoic acid Traditional Name: 3-[2-carboxyethyl-(laurylthio)carbothioyl-amino]propionic acid Formula: C19H35NO4S2 MolecularWeight: 405.6155

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSC(=S)N(CCC(=O)O)CCC(=O)O

Isomeric SMILES

CCCCCCCCCCCCSC(=S)N(CCC(=O)O)CCC(=O)O

InChI

InChI=1S/C19H35NO4S2/c1-2-3-4-5-6-7-8-9-10-11-16-26-19(25)20(14-12-17(21)22)15-13-18(23)24/h2-16H2,1H3,(H,21,22)(H,23,24)