[4-[2-(2-bromanyl-4-methyl-phenoxy)ethanoylamino]phenyl]sulfonyl-(2,6-dimethylpyrimidin-4-yl)azanide

Systemtic Name: [4-[2-(2-bromanyl-4-methyl-phenoxy)ethanoylamino]phenyl]sulfonyl-(2,6-dimethylpyrimidin-4-yl)azanide Openeye Name: [4-[[2-(2-bromo-4-methyl-phenoxy)acetyl]amino]phenyl]sulfonyl-(2,6-dimethylpyrimidin-4-yl)azanide CAS Name: [4-[[2-(2-bromo-4-methylphenoxy)-1-oxoethyl]amino]phenyl]sulfonyl-(2,6-dimethyl-4-pyrimidinyl)azanide IUPAC Name: [4-[[2-(2-bromo-4-methylphenoxy)acetyl]amino]phenyl]sulfonyl-(2,6-dimethylpyrimidin-4-yl)azanide Traditional Name: [4-[[2-(2-bromo-4-methyl-phenoxy)acetyl]amino]phenyl]sulfonyl-(2,6-dimethylpyrimidin-4-yl)azanide Formula: C21H20BrN4O4S- MolecularWeight: 504.3769

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC(=O)NC2=CC=C(C=C2)S(=O)(=O)[N-]C3=NC(=NC(=C3)C)C)Br

Isomeric SMILES

CC1=CC(=C(C=C1)OCC(=O)NC2=CC=C(C=C2)S(=O)(=O)[N-]C3=NC(=NC(=C3)C)C)Br

InChI

InChI=1S/C21H21BrN4O4S/c1-13-4-9-19(18(22)10-13)30-12-21(27)25-16-5-7-17(8-6-16)31(28,29)26-20-11-14(2)23-15(3)24-20/h4-11H,12H2,1-3H3,(H2,23,24,25,26,27)/p-1