2-[3-methyl-4-oxidanylidene-4-(1-phenylsulfanylpropan-2-ylamino)butan-2-yl]oxyethanoic acid

Systemtic Name: 2-[3-methyl-4-oxidanylidene-4-(1-phenylsulfanylpropan-2-ylamino)butan-2-yl]oxyethanoic acid Openeye Name: 2-[1,2-dimethyl-3-[(1-methyl-2-phenylsulfanyl-ethyl)amino]-3-oxo-propoxy]acetic acid CAS Name: 2-[3-methyl-4-oxo-4-[1-(phenylthio)propan-2-ylamino]butan-2-yl]oxyacetic acid IUPAC Name: 2-[3-methyl-4-oxo-4-(1-phenylsulfanylpropan-2-ylamino)butan-2-yl]oxyacetic acid Traditional Name: 2-[3-keto-1,2-dimethyl-3-[[1-methyl-2-(phenylthio)ethyl]amino]propoxy]acetic acid Formula: C16H23NO4S MolecularWeight: 325.42312

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC1=CC=CC=C1)NC(=O)C(C)C(C)OCC(=O)O

Isomeric SMILES

CC(CSC1=CC=CC=C1)NC(=O)C(C)C(C)OCC(=O)O

InChI

InChI=1S/C16H23NO4S/c1-11(10-22-14-7-5-4-6-8-14)17-16(20)12(2)13(3)21-9-15(18)19/h4-8,11-13H,9-10H2,1-3H3,(H,17,20)(H,18,19)