2-[2-(4-methoxyphenyl)sulfanylethanoylamino]-3,3-dimethyl-butanoic acid

Systemtic Name: 2-[2-(4-methoxyphenyl)sulfanylethanoylamino]-3,3-dimethyl-butanoic acid Openeye Name: 2-[[2-(4-methoxyphenyl)sulfanylacetyl]amino]-3,3-dimethyl-butanoic acid CAS Name: 2-[[2-[(4-methoxyphenyl)thio]-1-oxoethyl]amino]-3,3-dimethylbutanoic acid IUPAC Name: 2-[[2-(4-methoxyphenyl)sulfanylacetyl]amino]-3,3-dimethylbutanoic acid Traditional Name: 2-[[2-[(4-methoxyphenyl)thio]acetyl]amino]-3,3-dimethyl-butyric acid Formula: C15H21NO4S MolecularWeight: 311.39654

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21NO4S/c1-15(2,3)13(14(18)19)16-12(17)9-21-11-7-5-10(20-4)6-8-11/h5-8,13H,9H2,1-4H3,(H,16,17)(H,18,19)