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

Systemtic Name: 4-bromanyl-N-[[3,5-dimethyl-1-(2-methylphenyl)pyrazol-4-yl]methyl]-3-methyl-benzamide Openeye Name: 4-bromo-N-[[3,5-dimethyl-1-(o-tolyl)pyrazol-4-yl]methyl]-3-methyl-benzamide CAS Name: 4-bromo-N-[[3,5-dimethyl-1-(2-methylphenyl)-4-pyrazolyl]methyl]-3-methylbenzamide IUPAC Name: 4-bromo-N-[[3,5-dimethyl-1-(2-methylphenyl)pyrazol-4-yl]methyl]-3-methylbenzamide Traditional Name: 4-bromo-N-[[3,5-dimethyl-1-(o-tolyl)pyrazol-4-yl]methyl]-3-methyl-benzamide Formula: C21H22BrN3O MolecularWeight: 412.32288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=C(C(=N2)C)CNC(=O)C3=CC(=C(C=C3)Br)C)C

Isomeric SMILES

CC1=CC=CC=C1N2C(=C(C(=N2)C)CNC(=O)C3=CC(=C(C=C3)Br)C)C

InChI

InChI=1S/C21H22BrN3O/c1-13-7-5-6-8-20(13)25-16(4)18(15(3)24-25)12-23-21(26)17-9-10-19(22)14(2)11-17/h5-11H,12H2,1-4H3,(H,23,26)