4-[5-(2,2-dimethylpropyl)-3-phenyl-1,2-oxazol-4-yl]benzenesulfonamide

Systemtic Name: 4-[5-(2,2-dimethylpropyl)-3-phenyl-1,2-oxazol-4-yl]benzenesulfonamide Openeye Name: 4-[5-(2,2-dimethylpropyl)-3-phenyl-isoxazol-4-yl]benzenesulfonamide CAS Name: 4-[5-(2,2-dimethylpropyl)-3-phenyl-4-isoxazolyl]benzenesulfonamide IUPAC Name: 4-[5-(2,2-dimethylpropyl)-3-phenyl-1,2-oxazol-4-yl]benzenesulfonamide Traditional Name: 4-(5-neopentyl-3-phenyl-isoxazol-4-yl)benzenesulfonamide Formula: C20H22N2O3S MolecularWeight: 370.46528

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC1=C(C(=NO1)C2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CC(C)(C)CC1=C(C(=NO1)C2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C20H22N2O3S/c1-20(2,3)13-17-18(14-9-11-16(12-10-14)26(21,23)24)19(22-25-17)15-7-5-4-6-8-15/h4-12H,13H2,1-3H3,(H2,21,23,24)