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

Systemtic Name: 2-[1-oxidanylidene-1-(propan-2-ylamino)propan-2-yl]sulfanylpropanoic acid Openeye Name: 2-[2-(isopropylamino)-1-methyl-2-oxo-ethyl]sulfanylpropanoic acid CAS Name: 2-[[1-oxo-1-(propan-2-ylamino)propan-2-yl]thio]propanoic acid IUPAC Name: 2-[1-oxo-1-(propan-2-ylamino)propan-2-yl]sulfanylpropanoic acid Traditional Name: 2-[[2-(isopropylamino)-2-keto-1-methyl-ethyl]thio]propionic acid Formula: C9H17NO3S MolecularWeight: 219.30118

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C(C)SC(C)C(=O)O

Isomeric SMILES

CC(C)NC(=O)C(C)SC(C)C(=O)O

InChI

InChI=1S/C9H17NO3S/c1-5(2)10-8(11)6(3)14-7(4)9(12)13/h5-7H,1-4H3,(H,10,11)(H,12,13)