2-[cyclohexyl-[2-(3,3-dimethylbutanoylsulfanyl)-2-methyl-propanoyl]amino]ethanoic acid

Systemtic Name: 2-[cyclohexyl-[2-(3,3-dimethylbutanoylsulfanyl)-2-methyl-propanoyl]amino]ethanoic acid Openeye Name: 2-[cyclohexyl-[2-(3,3-dimethylbutanoylsulfanyl)-2-methyl-propanoyl]amino]acetic acid CAS Name: 2-[cyclohexyl-[2-[(3,3-dimethyl-1-oxobutyl)thio]-2-methyl-1-oxopropyl]amino]acetic acid IUPAC Name: 2-[cyclohexyl-[2-(3,3-dimethylbutanoylsulfanyl)-2-methylpropanoyl]amino]acetic acid Traditional Name: 2-[cyclohexyl-[2-(3,3-dimethylbutanoylthio)-2-methyl-propanoyl]amino]acetic acid Formula: C18H31NO4S MolecularWeight: 357.50804

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)SC(C)(C)C(=O)N(CC(=O)O)C1CCCCC1

Isomeric SMILES

CC(C)(C)CC(=O)SC(C)(C)C(=O)N(CC(=O)O)C1CCCCC1

InChI

InChI=1S/C18H31NO4S/c1-17(2,3)11-15(22)24-18(4,5)16(23)19(12-14(20)21)13-9-7-6-8-10-13/h13H,6-12H2,1-5H3,(H,20,21)