2-(5-bromanyl-1-benzofuran-3-yl)-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)ethanamide

Systemtic Name: 2-(5-bromanyl-1-benzofuran-3-yl)-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)ethanamide Openeye Name: 2-(5-bromobenzofuran-3-yl)-N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)acetamide CAS Name: 2-(5-bromo-3-benzofuranyl)-N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)acetamide IUPAC Name: 2-(5-bromo-1-benzofuran-3-yl)-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)acetamide Traditional Name: 2-(5-bromobenzofuran-3-yl)-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)acetamide Formula: C21H18BrN3O3 MolecularWeight: 440.28992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)CC3=COC4=C3C=C(C=C4)Br

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)CC3=COC4=C3C=C(C=C4)Br

InChI

InChI=1S/C21H18BrN3O3/c1-13-20(21(27)25(24(13)2)16-6-4-3-5-7-16)23-19(26)10-14-12-28-18-9-8-15(22)11-17(14)18/h3-9,11-12H,10H2,1-2H3,(H,23,26)