2-[2-(2,2-dimethylpropanoylamino)phenyl]sulfanyl-2-methyl-propanoic acid

Systemtic Name: 2-[2-(2,2-dimethylpropanoylamino)phenyl]sulfanyl-2-methyl-propanoic acid Openeye Name: 2-[2-(2,2-dimethylpropanoylamino)phenyl]sulfanyl-2-methyl-propanoic acid CAS Name: 2-[[2-[(2,2-dimethyl-1-oxopropyl)amino]phenyl]thio]-2-methylpropanoic acid IUPAC Name: 2-[2-(2,2-dimethylpropanoylamino)phenyl]sulfanyl-2-methylpropanoic acid Traditional Name: 2-methyl-2-[[2-(pivaloylamino)phenyl]thio]propionic acid Formula: C15H21NO3S MolecularWeight: 295.39714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=CC=CC=C1SC(C)(C)C(=O)O

Isomeric SMILES

CC(C)(C)C(=O)NC1=CC=CC=C1SC(C)(C)C(=O)O

InChI

InChI=1S/C15H21NO3S/c1-14(2,3)12(17)16-10-8-6-7-9-11(10)20-15(4,5)13(18)19/h6-9H,1-5H3,(H,16,17)(H,18,19)