2-[2-[(4-chlorophenyl)methylsulfanyl]ethanoylamino]-3,3-dimethyl-butanoic acid

Systemtic Name: 2-[2-[(4-chlorophenyl)methylsulfanyl]ethanoylamino]-3,3-dimethyl-butanoic acid Openeye Name: 2-[[2-[(4-chlorophenyl)methylsulfanyl]acetyl]amino]-3,3-dimethyl-butanoic acid CAS Name: 2-[[2-[(4-chlorophenyl)methylthio]-1-oxoethyl]amino]-3,3-dimethylbutanoic acid IUPAC Name: 2-[[2-[(4-chlorophenyl)methylsulfanyl]acetyl]amino]-3,3-dimethylbutanoic acid Traditional Name: 2-[[2-[(4-chlorobenzyl)thio]acetyl]amino]-3,3-dimethyl-butyric acid Formula: C15H20ClNO3S MolecularWeight: 329.8422

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)O)NC(=O)CSCC1=CC=C(C=C1)Cl

Isomeric SMILES

CC(C)(C)C(C(=O)O)NC(=O)CSCC1=CC=C(C=C1)Cl

InChI

InChI=1S/C15H20ClNO3S/c1-15(2,3)13(14(19)20)17-12(18)9-21-8-10-4-6-11(16)7-5-10/h4-7,13H,8-9H2,1-3H3,(H,17,18)(H,19,20)