2-(2-butylsulfanylethylamino)-4-methyl-pentanoic acid

Systemtic Name: 2-(2-butylsulfanylethylamino)-4-methyl-pentanoic acid Openeye Name: 2-(2-butylsulfanylethylamino)-4-methyl-pentanoic acid CAS Name: 2-[2-(butylthio)ethylamino]-4-methylpentanoic acid IUPAC Name: 2-(2-butylsulfanylethylamino)-4-methylpentanoic acid Traditional Name: 2-[2-(butylthio)ethylamino]-4-methyl-valeric acid Formula: C12H25NO2S MolecularWeight: 247.3974

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSCCNC(CC(C)C)C(=O)O

Isomeric SMILES

CCCCSCCNC(CC(C)C)C(=O)O

InChI

InChI=1S/C12H25NO2S/c1-4-5-7-16-8-6-13-11(12(14)15)9-10(2)3/h10-11,13H,4-9H2,1-3H3,(H,14,15)