2-methyl-5-(3-methyl-1,2-oxazol-5-yl)-N-[2-(4-sulfamoylphenyl)ethyl]benzenesulfonamide

Systemtic Name: 2-methyl-5-(3-methyl-1,2-oxazol-5-yl)-N-[2-(4-sulfamoylphenyl)ethyl]benzenesulfonamide Openeye Name: 2-methyl-5-(3-methylisoxazol-5-yl)-N-[2-(4-sulfamoylphenyl)ethyl]benzenesulfonamide CAS Name: 2-methyl-5-(3-methyl-5-isoxazolyl)-N-[2-(4-sulfamoylphenyl)ethyl]benzenesulfonamide IUPAC Name: 2-methyl-5-(3-methyl-1,2-oxazol-5-yl)-N-[2-(4-sulfamoylphenyl)ethyl]benzenesulfonamide Traditional Name: 2-methyl-5-(3-methylisoxazol-5-yl)-N-[2-(4-sulfamoylphenyl)ethyl]benzenesulfonamide Formula: C19H21N3O5S2 MolecularWeight: 435.51714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CC(=NO2)C)S(=O)(=O)NCCC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CC(=NO2)C)S(=O)(=O)NCCC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C19H21N3O5S2/c1-13-3-6-16(18-11-14(2)22-27-18)12-19(13)29(25,26)21-10-9-15-4-7-17(8-5-15)28(20,23)24/h3-8,11-12,21H,9-10H2,1-2H3,(H2,20,23,24)