2-azanyl-3-(4-methylsulfinylbutylcarbamothioylsulfanyl)propanoic acid

Systemtic Name: 2-azanyl-3-(4-methylsulfinylbutylcarbamothioylsulfanyl)propanoic acid Openeye Name: 2-amino-3-(4-methylsulfinylbutylcarbamothioylsulfanyl)propanoic acid CAS Name: 2-amino-3-[[(4-methylsulfinylbutylamino)-sulfanylidenemethyl]thio]propanoic acid IUPAC Name: 2-amino-3-(4-methylsulfinylbutylcarbamothioylsulfanyl)propanoic acid Traditional Name: 2-amino-3-(4-methylsulfinylbutylthiocarbamoylthio)propionic acid Formula: C9H18N2O3S3 MolecularWeight: 298.44582

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)CCCCNC(=S)SCC(C(=O)O)N

Isomeric SMILES

CS(=O)CCCCNC(=S)SCC(C(=O)O)N

InChI

InChI=1S/C9H18N2O3S3/c1-17(14)5-3-2-4-11-9(15)16-6-7(10)8(12)13/h7H,2-6,10H2,1H3,(H,11,15)(H,12,13)