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

Systemtic Name: 2-(2-butylsulfanylethanoylamino)-4-methyl-pentanoic acid Openeye Name: 2-[(2-butylsulfanylacetyl)amino]-4-methyl-pentanoic acid CAS Name: 2-[[2-(butylthio)-1-oxoethyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[(2-butylsulfanylacetyl)amino]-4-methylpentanoic acid Traditional Name: 2-[[2-(butylthio)acetyl]amino]-4-methyl-valeric acid Formula: C12H23NO3S MolecularWeight: 261.38092

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H23NO3S/c1-4-5-6-17-8-11(14)13-10(12(15)16)7-9(2)3/h9-10H,4-8H2,1-3H3,(H,13,14)(H,15,16)