2-[2-(2,2-dimethylpropanoylamino)phenyl]sulfanylbutanoic acid

Systemtic Name: 2-[2-(2,2-dimethylpropanoylamino)phenyl]sulfanylbutanoic acid Openeye Name: 2-[2-(2,2-dimethylpropanoylamino)phenyl]sulfanylbutanoic acid CAS Name: 2-[[2-[(2,2-dimethyl-1-oxopropyl)amino]phenyl]thio]butanoic acid IUPAC Name: 2-[2-(2,2-dimethylpropanoylamino)phenyl]sulfanylbutanoic acid Traditional Name: 2-[[2-(pivaloylamino)phenyl]thio]butyric acid Formula: C15H21NO3S MolecularWeight: 295.39714

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)SC1=CC=CC=C1NC(=O)C(C)(C)C

Isomeric SMILES

CCC(C(=O)O)SC1=CC=CC=C1NC(=O)C(C)(C)C

InChI

InChI=1S/C15H21NO3S/c1-5-11(13(17)18)20-12-9-7-6-8-10(12)16-14(19)15(2,3)4/h6-9,11H,5H2,1-4H3,(H,16,19)(H,17,18)