3-[(2S)-1-oxidanylidene-1-(propan-2-ylamino)propan-2-yl]sulfanylpropanoate

Systemtic Name: 3-[(2S)-1-oxidanylidene-1-(propan-2-ylamino)propan-2-yl]sulfanylpropanoate Openeye Name: 3-[(1S)-2-(isopropylamino)-1-methyl-2-oxo-ethyl]sulfanylpropanoate CAS Name: 3-[[(2S)-1-oxo-1-(propan-2-ylamino)propan-2-yl]thio]propanoate IUPAC Name: 3-[(2S)-1-oxo-1-(propan-2-ylamino)propan-2-yl]sulfanylpropanoate Traditional Name: 3-[[(1S)-2-(isopropylamino)-2-keto-1-methyl-ethyl]thio]propionate Formula: C9H16NO3S- MolecularWeight: 218.29324

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C(C)SCCC(=O)[O-]

Isomeric SMILES

C[C@@H](C(=O)NC(C)C)SCCC(=O)[O-]

InChI

InChI=1S/C9H17NO3S/c1-6(2)10-9(13)7(3)14-5-4-8(11)12/h6-7H,4-5H2,1-3H3,(H,10,13)(H,11,12)/p-1/t7-/m0/s1