3-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(4-propan-2-ylphenyl)benzamide

Systemtic Name: 3-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(4-propan-2-ylphenyl)benzamide Openeye Name: 3-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(4-isopropylphenyl)benzamide CAS Name: 3-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]-N-(4-propan-2-ylphenyl)benzamide IUPAC Name: 3-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-N-(4-propan-2-ylphenyl)benzamide Traditional Name: 3-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-N-p-cumenyl-benzamide Formula: C22H24BrN3O MolecularWeight: 426.34946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC(=C2)C(=O)NC3=CC=C(C=C3)C(C)C)C)Br

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC(=C2)C(=O)NC3=CC=C(C=C3)C(C)C)C)Br

InChI

InChI=1S/C22H24BrN3O/c1-14(2)18-8-10-20(11-9-18)24-22(27)19-7-5-6-17(12-19)13-26-16(4)21(23)15(3)25-26/h5-12,14H,13H2,1-4H3,(H,24,27)