butanoylsulfanyl 3-[4-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]propanoate

Systemtic Name: butanoylsulfanyl 3-[4-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]propanoate Openeye Name: butanoylsulfanyl 3-[4-[2-(5-methyl-2-phenyl-oxazol-4-yl)ethoxy]phenyl]propanoate CAS Name: 3-[4-[2-(5-methyl-2-phenyl-4-oxazolyl)ethoxy]phenyl]propanoic acid (1-oxobutylthio) ester IUPAC Name: butanoylsulfanyl 3-[4-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]propanoate Traditional Name: 3-[4-[2-(5-methyl-2-phenyl-oxazol-4-yl)ethoxy]phenyl]propionic acid (butyrylthio) ester Formula: C25H27NO5S MolecularWeight: 453.55058

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)SOC(=O)CCC1=CC=C(C=C1)OCCC2=C(OC(=N2)C3=CC=CC=C3)C

Isomeric SMILES

CCCC(=O)SOC(=O)CCC1=CC=C(C=C1)OCCC2=C(OC(=N2)C3=CC=CC=C3)C

InChI

InChI=1S/C25H27NO5S/c1-3-7-24(28)32-31-23(27)15-12-19-10-13-21(14-11-19)29-17-16-22-18(2)30-25(26-22)20-8-5-4-6-9-20/h4-6,8-11,13-14H,3,7,12,15-17H2,1-2H3