6-bromanyl-N-[4-(6-methylsulfonylpyridazin-3-yl)phenyl]-2-oxidanylidene-chromene-3-carboxamide

Systemtic Name: 6-bromanyl-N-[4-(6-methylsulfonylpyridazin-3-yl)phenyl]-2-oxidanylidene-chromene-3-carboxamide Openeye Name: 6-bromo-N-[4-(6-methylsulfonylpyridazin-3-yl)phenyl]-2-oxo-chromene-3-carboxamide CAS Name: 6-bromo-N-[4-(6-methylsulfonyl-3-pyridazinyl)phenyl]-2-oxo-1-benzopyran-3-carboxamide IUPAC Name: 6-bromo-N-[4-(6-methylsulfonylpyridazin-3-yl)phenyl]-2-oxochromene-3-carboxamide Traditional Name: 6-bromo-2-keto-N-[4-(6-mesylpyridazin-3-yl)phenyl]chromene-3-carboxamide Formula: C21H14BrN3O5S MolecularWeight: 500.32196

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=NN=C(C=C1)C2=CC=C(C=C2)NC(=O)C3=CC4=C(C=CC(=C4)Br)OC3=O

Isomeric SMILES

CS(=O)(=O)C1=NN=C(C=C1)C2=CC=C(C=C2)NC(=O)C3=CC4=C(C=CC(=C4)Br)OC3=O

InChI

InChI=1S/C21H14BrN3O5S/c1-31(28,29)19-9-7-17(24-25-19)12-2-5-15(6-3-12)23-20(26)16-11-13-10-14(22)4-8-18(13)30-21(16)27/h2-11H,1H3,(H,23,26)