2-(butylamino)-4-butylsulfanyl-butanoic acid

Systemtic Name: 2-(butylamino)-4-butylsulfanyl-butanoic acid Openeye Name: 2-(butylamino)-4-butylsulfanyl-butanoic acid CAS Name: 2-(butylamino)-4-(butylthio)butanoic acid IUPAC Name: 2-(butylamino)-4-butylsulfanylbutanoic acid Traditional Name: 2-(butylamino)-4-(butylthio)butyric acid Formula: C12H25NO2S MolecularWeight: 247.3974

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(CCSCCCC)C(=O)O

Isomeric SMILES

CCCCNC(CCSCCCC)C(=O)O

InChI

InChI=1S/C12H25NO2S/c1-3-5-8-13-11(12(14)15)7-10-16-9-6-4-2/h11,13H,3-10H2,1-2H3,(H,14,15)