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

Systemtic Name: 3-[2-carboxyethyl(decylsulfanylcarbothioyl)amino]propanoic acid Openeye Name: 3-[2-carboxyethyl(decylsulfanylcarbothioyl)amino]propanoic acid CAS Name: 3-[2-carboxyethyl-[(decylthio)-sulfanylidenemethyl]amino]propanoic acid IUPAC Name: 3-[2-carboxyethyl(decylsulfanylcarbothioyl)amino]propanoic acid Traditional Name: 3-[2-carboxyethyl-(decylthio)carbothioyl-amino]propionic acid Formula: C17H31NO4S2 MolecularWeight: 377.56234

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCSC(=S)N(CCC(=O)O)CCC(=O)O

Isomeric SMILES

CCCCCCCCCCSC(=S)N(CCC(=O)O)CCC(=O)O

InChI

InChI=1S/C17H31NO4S2/c1-2-3-4-5-6-7-8-9-14-24-17(23)18(12-10-15(19)20)13-11-16(21)22/h2-14H2,1H3,(H,19,20)(H,21,22)