2-(2-butylsulfanylethanoylamino)-3-methyl-butanoic acid

Systemtic Name: 2-(2-butylsulfanylethanoylamino)-3-methyl-butanoic acid Openeye Name: 2-[(2-butylsulfanylacetyl)amino]-3-methyl-butanoic acid CAS Name: 2-[[2-(butylthio)-1-oxoethyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[(2-butylsulfanylacetyl)amino]-3-methylbutanoic acid Traditional Name: 2-[[2-(butylthio)acetyl]amino]-3-methyl-butyric acid Formula: C11H21NO3S MolecularWeight: 247.35434

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSCC(=O)NC(C(C)C)C(=O)O

Isomeric SMILES

CCCCSCC(=O)NC(C(C)C)C(=O)O

InChI

InChI=1S/C11H21NO3S/c1-4-5-6-16-7-9(13)12-10(8(2)3)11(14)15/h8,10H,4-7H2,1-3H3,(H,12,13)(H,14,15)