4-bromanyl-3-methyl-N-[3-(2-methylpyrimidin-4-yl)phenyl]benzenesulfonamide

Systemtic Name: 4-bromanyl-3-methyl-N-[3-(2-methylpyrimidin-4-yl)phenyl]benzenesulfonamide Openeye Name: 4-bromo-3-methyl-N-[3-(2-methylpyrimidin-4-yl)phenyl]benzenesulfonamide CAS Name: 4-bromo-3-methyl-N-[3-(2-methyl-4-pyrimidinyl)phenyl]benzenesulfonamide IUPAC Name: 4-bromo-3-methyl-N-[3-(2-methylpyrimidin-4-yl)phenyl]benzenesulfonamide Traditional Name: 4-bromo-3-methyl-N-[3-(2-methylpyrimidin-4-yl)phenyl]benzenesulfonamide Formula: C18H16BrN3O2S MolecularWeight: 418.30754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)NC2=CC=CC(=C2)C3=NC(=NC=C3)C)Br

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)NC2=CC=CC(=C2)C3=NC(=NC=C3)C)Br

InChI

InChI=1S/C18H16BrN3O2S/c1-12-10-16(6-7-17(12)19)25(23,24)22-15-5-3-4-14(11-15)18-8-9-20-13(2)21-18/h3-11,22H,1-2H3