N-(4-bromanyl-3-tert-butyl-1,2-oxazol-5-yl)-N-(phenylsulfonyl)benzenesulfonamide

Systemtic Name: N-(4-bromanyl-3-tert-butyl-1,2-oxazol-5-yl)-N-(phenylsulfonyl)benzenesulfonamide Openeye Name: N-(benzenesulfonyl)-N-(4-bromo-3-tert-butyl-isoxazol-5-yl)benzenesulfonamide CAS Name: N-(benzenesulfonyl)-N-(4-bromo-3-tert-butyl-5-isoxazolyl)benzenesulfonamide IUPAC Name: N-(benzenesulfonyl)-N-(4-bromo-3-tert-butyl-1,2-oxazol-5-yl)benzenesulfonamide Traditional Name: N-besyl-N-(4-bromo-3-tert-butyl-isoxazol-5-yl)benzenesulfonamide Formula: C19H19BrN2O5S2 MolecularWeight: 499.39856

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NOC(=C1Br)N(S(=O)(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=NOC(=C1Br)N(S(=O)(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H19BrN2O5S2/c1-19(2,3)17-16(20)18(27-21-17)22(28(23,24)14-10-6-4-7-11-14)29(25,26)15-12-8-5-9-13-15/h4-13H,1-3H3