2-ethyl-5-(3-methyl-1,2-oxazol-5-yl)-N-(3-methylsulfanylphenyl)benzenesulfonamide

Systemtic Name: 2-ethyl-5-(3-methyl-1,2-oxazol-5-yl)-N-(3-methylsulfanylphenyl)benzenesulfonamide Openeye Name: 2-ethyl-5-(3-methylisoxazol-5-yl)-N-(3-methylsulfanylphenyl)benzenesulfonamide CAS Name: 2-ethyl-5-(3-methyl-5-isoxazolyl)-N-[3-(methylthio)phenyl]benzenesulfonamide IUPAC Name: 2-ethyl-5-(3-methyl-1,2-oxazol-5-yl)-N-(3-methylsulfanylphenyl)benzenesulfonamide Traditional Name: 2-ethyl-5-(3-methylisoxazol-5-yl)-N-[3-(methylthio)phenyl]benzenesulfonamide Formula: C19H20N2O3S2 MolecularWeight: 388.5037

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)C2=CC(=NO2)C)S(=O)(=O)NC3=CC(=CC=C3)SC

Isomeric SMILES

CCC1=C(C=C(C=C1)C2=CC(=NO2)C)S(=O)(=O)NC3=CC(=CC=C3)SC

InChI

InChI=1S/C19H20N2O3S2/c1-4-14-8-9-15(18-10-13(2)20-24-18)11-19(14)26(22,23)21-16-6-5-7-17(12-16)25-3/h5-12,21H,4H2,1-3H3