3-[2-(3-bromanylphenoxy)ethanoylamino]-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)benzamide

Systemtic Name: 3-[2-(3-bromanylphenoxy)ethanoylamino]-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)benzamide Openeye Name: 3-[[2-(3-bromophenoxy)acetyl]amino]-N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)benzamide CAS Name: 3-[[2-(3-bromophenoxy)-1-oxoethyl]amino]-N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)benzamide IUPAC Name: 3-[[2-(3-bromophenoxy)acetyl]amino]-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)benzamide Traditional Name: 3-[[2-(3-bromophenoxy)acetyl]amino]-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)benzamide Formula: C26H23BrN4O4 MolecularWeight: 535.38922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C3=CC(=CC=C3)NC(=O)COC4=CC(=CC=C4)Br

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C3=CC(=CC=C3)NC(=O)COC4=CC(=CC=C4)Br

InChI

InChI=1S/C26H23BrN4O4/c1-17-24(26(34)31(30(17)2)21-11-4-3-5-12-21)29-25(33)18-8-6-10-20(14-18)28-23(32)16-35-22-13-7-9-19(27)15-22/h3-15H,16H2,1-2H3,(H,28,32)(H,29,33)