2-[2-azanyl-4-(2-methylpropyl)phenyl]-N-(3,4-dimethyl-4,5-dihydro-1,2-oxazol-5-yl)benzenesulfonamide

Systemtic Name: 2-[2-azanyl-4-(2-methylpropyl)phenyl]-N-(3,4-dimethyl-4,5-dihydro-1,2-oxazol-5-yl)benzenesulfonamide Openeye Name: 2-(2-amino-4-isobutyl-phenyl)-N-(3,4-dimethyl-4,5-dihydroisoxazol-5-yl)benzenesulfonamide CAS Name: 2-[2-amino-4-(2-methylpropyl)phenyl]-N-(3,4-dimethyl-4,5-dihydroisoxazol-5-yl)benzenesulfonamide IUPAC Name: 2-[2-amino-4-(2-methylpropyl)phenyl]-N-(3,4-dimethyl-4,5-dihydro-1,2-oxazol-5-yl)benzenesulfonamide Traditional Name: 2-(2-amino-4-isobutyl-phenyl)-N-(3,4-dimethyl-2-isoxazolin-5-yl)benzenesulfonamide Formula: C21H27N3O3S MolecularWeight: 401.52238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(ON=C1C)NS(=O)(=O)C2=CC=CC=C2C3=C(C=C(C=C3)CC(C)C)N

Isomeric SMILES

CC1C(ON=C1C)NS(=O)(=O)C2=CC=CC=C2C3=C(C=C(C=C3)CC(C)C)N

InChI

InChI=1S/C21H27N3O3S/c1-13(2)11-16-9-10-17(19(22)12-16)18-7-5-6-8-20(18)28(25,26)24-21-14(3)15(4)23-27-21/h5-10,12-14,21,24H,11,22H2,1-4H3