2-(2-bromanyl-4-methyl-phenoxy)-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)propanamide

Systemtic Name: 2-(2-bromanyl-4-methyl-phenoxy)-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)propanamide Openeye Name: 2-(2-bromo-4-methyl-phenoxy)-N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)propanamide CAS Name: 2-(2-bromo-4-methylphenoxy)-N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)propanamide IUPAC Name: 2-(2-bromo-4-methylphenoxy)-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)propanamide Traditional Name: 2-(2-bromo-4-methyl-phenoxy)-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)propionamide Formula: C21H22BrN3O3 MolecularWeight: 444.32168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC(C)C(=O)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)Br

Isomeric SMILES

CC1=CC(=C(C=C1)OC(C)C(=O)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)Br

InChI

InChI=1S/C21H22BrN3O3/c1-13-10-11-18(17(22)12-13)28-15(3)20(26)23-19-14(2)24(4)25(21(19)27)16-8-6-5-7-9-16/h5-12,15H,1-4H3,(H,23,26)