2-[1-oxidanylidene-1-(pentan-2-ylamino)propan-2-yl]sulfanylpropanoic acid

Systemtic Name: 2-[1-oxidanylidene-1-(pentan-2-ylamino)propan-2-yl]sulfanylpropanoic acid Openeye Name: 2-[1-methyl-2-(1-methylbutylamino)-2-oxo-ethyl]sulfanylpropanoic acid CAS Name: 2-[[1-oxo-1-(pentan-2-ylamino)propan-2-yl]thio]propanoic acid IUPAC Name: 2-[1-oxo-1-(pentan-2-ylamino)propan-2-yl]sulfanylpropanoic acid Traditional Name: 2-[[2-keto-1-methyl-2-(1-methylbutylamino)ethyl]thio]propionic acid Formula: C11H21NO3S MolecularWeight: 247.35434

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)C(C)SC(C)C(=O)O

Isomeric SMILES

CCCC(C)NC(=O)C(C)SC(C)C(=O)O

InChI

InChI=1S/C11H21NO3S/c1-5-6-7(2)12-10(13)8(3)16-9(4)11(14)15/h7-9H,5-6H2,1-4H3,(H,12,13)(H,14,15)