4-[(5-bromanyl-2-oxidanyl-phenyl)methylamino]-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide

Systemtic Name: 4-[(5-bromanyl-2-oxidanyl-phenyl)methylamino]-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide Openeye Name: 4-[(5-bromo-2-hydroxy-phenyl)methylamino]-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide CAS Name: 4-[(5-bromo-2-hydroxyphenyl)methylamino]-N-(4,6-dimethyl-2-pyrimidinyl)benzenesulfonamide IUPAC Name: 4-[(5-bromo-2-hydroxyphenyl)methylamino]-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide Traditional Name: 4-[(5-bromo-2-hydroxy-benzyl)amino]-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide Formula: C19H19BrN4O3S MolecularWeight: 463.34816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)NCC3=C(C=CC(=C3)Br)O)C

Isomeric SMILES

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)NCC3=C(C=CC(=C3)Br)O)C

InChI

InChI=1S/C19H19BrN4O3S/c1-12-9-13(2)23-19(22-12)24-28(26,27)17-6-4-16(5-7-17)21-11-14-10-15(20)3-8-18(14)25/h3-10,21,25H,11H2,1-2H3,(H,22,23,24)