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4-[4-methyl-2-(10-propylsulfanyldecanoylamino)phenoxy]butanoic acid

4-[4-methyl-2-(10-propylsulfanyldecanoylamino)phenoxy]butanoic acid

Systemtic Name:4-[4-methyl-2-(10-propylsulfanyldecanoylamino)phenoxy]butanoic acid
Openeye Name:4-[4-methyl-2-(10-propylsulfanyldecanoylamino)phenoxy]butanoic acid
CAS Name:4-[4-methyl-2-[[1-oxo-10-(propylthio)decyl]amino]phenoxy]butanoic acid
IUPAC Name:4-[4-methyl-2-(10-propylsulfanyldecanoylamino)phenoxy]butanoic acid
Traditional Name:4-[4-methyl-2-[10-(propylthio)decanoylamino]phenoxy]butyric acid
Formula: C24H39NO4S
MolecularWeight: 437.63576
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Descriptors Computed from Structure

Canonical SMILES:

CCCSCCCCCCCCCC(=O)NC1=C(C=CC(=C1)C)OCCCC(=O)O


Isomeric SMILES

CCCSCCCCCCCCCC(=O)NC1=C(C=CC(=C1)C)OCCCC(=O)O


InChI

InChI=1S/C24H39NO4S/c1-3-17-30-18-10-8-6-4-5-7-9-12-23(26)25-21-19-20(2)14-15-22(21)29-16-11-13-24(27)28/h14-15,19H,3-13,16-18H2,1-2H3,(H,25,26)(H,27,28)


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