4-[2-(10-ethylsulfanyldecanoylamino)-3,5-dimethyl-phenoxy]butanoic acid

Systemtic Name: 4-[2-(10-ethylsulfanyldecanoylamino)-3,5-dimethyl-phenoxy]butanoic acid Openeye Name: 4-[2-(10-ethylsulfanyldecanoylamino)-3,5-dimethyl-phenoxy]butanoic acid CAS Name: 4-[2-[[10-(ethylthio)-1-oxodecyl]amino]-3,5-dimethylphenoxy]butanoic acid IUPAC Name: 4-[2-(10-ethylsulfanyldecanoylamino)-3,5-dimethylphenoxy]butanoic acid Traditional Name: 4-[2-[10-(ethylthio)decanoylamino]-3,5-dimethyl-phenoxy]butyric acid Formula: C24H39NO4S MolecularWeight: 437.63576

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Descriptors Computed from Structure

Canonical SMILES:

CCSCCCCCCCCCC(=O)NC1=C(C=C(C=C1OCCCC(=O)O)C)C

Isomeric SMILES

CCSCCCCCCCCCC(=O)NC1=C(C=C(C=C1OCCCC(=O)O)C)C

InChI

InChI=1S/C24H39NO4S/c1-4-30-16-11-9-7-5-6-8-10-13-22(26)25-24-20(3)17-19(2)18-21(24)29-15-12-14-23(27)28/h17-18H,4-16H2,1-3H3,(H,25,26)(H,27,28)