(4-bromophenyl)sulfonyl-[[(5-tert-butyl-1,2-oxazol-3-yl)amino]-phenyl-methylidene]azanium

Systemtic Name: (4-bromophenyl)sulfonyl-[[(5-tert-butyl-1,2-oxazol-3-yl)amino]-phenyl-methylidene]azanium Openeye Name: (4-bromophenyl)sulfonyl-[[(5-tert-butylisoxazol-3-yl)amino]-phenyl-methylene]ammonium CAS Name: (4-bromophenyl)sulfonyl-[[(5-tert-butyl-3-isoxazolyl)amino]-phenylmethylidene]ammonium IUPAC Name: (4-bromophenyl)sulfonyl-[[(5-tert-butyl-1,2-oxazol-3-yl)amino]-phenylmethylidene]azanium Traditional Name: brosyl-[[(5-tert-butylisoxazol-3-yl)amino]-phenyl-methylene]ammonium Formula: C20H21BrN3O3S+ MolecularWeight: 463.36804

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NO1)NC(=[NH+]S(=O)(=O)C2=CC=C(C=C2)Br)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=CC(=NO1)NC(=[NH+]S(=O)(=O)C2=CC=C(C=C2)Br)C3=CC=CC=C3

InChI

InChI=1S/C20H20BrN3O3S/c1-20(2,3)17-13-18(23-27-17)22-19(14-7-5-4-6-8-14)24-28(25,26)16-11-9-15(21)10-12-16/h4-13H,1-3H3,(H,22,23,24)/p+1