2-bromanyl-4,5-dimethoxy-N-[3-(2-methylpyrimidin-4-yl)phenyl]benzenesulfonamide

Systemtic Name: 2-bromanyl-4,5-dimethoxy-N-[3-(2-methylpyrimidin-4-yl)phenyl]benzenesulfonamide Openeye Name: 2-bromo-4,5-dimethoxy-N-[3-(2-methylpyrimidin-4-yl)phenyl]benzenesulfonamide CAS Name: 2-bromo-4,5-dimethoxy-N-[3-(2-methyl-4-pyrimidinyl)phenyl]benzenesulfonamide IUPAC Name: 2-bromo-4,5-dimethoxy-N-[3-(2-methylpyrimidin-4-yl)phenyl]benzenesulfonamide Traditional Name: 2-bromo-4,5-dimethoxy-N-[3-(2-methylpyrimidin-4-yl)phenyl]benzenesulfonamide Formula: C19H18BrN3O4S MolecularWeight: 464.33292

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18BrN3O4S/c1-12-21-8-7-16(22-12)13-5-4-6-14(9-13)23-28(24,25)19-11-18(27-3)17(26-2)10-15(19)20/h4-11,23H,1-3H3