butyl 4-[[2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]phenyl]carbonylamino]benzoate

Systemtic Name: butyl 4-[[2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]phenyl]carbonylamino]benzoate Openeye Name: butyl 4-[[2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]benzoyl]amino]benzoate CAS Name: 4-[[[2-[(3,5-dimethyl-4-isoxazolyl)methylthio]phenyl]-oxomethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]benzoyl]amino]benzoate Traditional Name: 4-[[2-[(3,5-dimethylisoxazol-4-yl)methylthio]benzoyl]amino]benzoic acid butyl ester Formula: C24H26N2O4S MolecularWeight: 438.53924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2SCC3=C(ON=C3C)C

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2SCC3=C(ON=C3C)C

InChI

InChI=1S/C24H26N2O4S/c1-4-5-14-29-24(28)18-10-12-19(13-11-18)25-23(27)20-8-6-7-9-22(20)31-15-21-16(2)26-30-17(21)3/h6-13H,4-5,14-15H2,1-3H3,(H,25,27)