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

Systemtic Name: 3-bromanyl-N-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methyl]-4-methoxy-benzamide Openeye Name: N-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyl]-3-bromo-4-methoxy-benzamide CAS Name: 3-bromo-N-[[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]methyl]-4-methoxybenzamide IUPAC Name: N-[(1-benzyl-3,5-dimethylpyrazol-4-yl)methyl]-3-bromo-4-methoxybenzamide Traditional Name: N-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyl]-3-bromo-4-methoxy-benzamide Formula: C21H22BrN3O2 MolecularWeight: 428.32228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2)C)CNC(=O)C3=CC(=C(C=C3)OC)Br

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2)C)CNC(=O)C3=CC(=C(C=C3)OC)Br

InChI

InChI=1S/C21H22BrN3O2/c1-14-18(15(2)25(24-14)13-16-7-5-4-6-8-16)12-23-21(26)17-9-10-20(27-3)19(22)11-17/h4-11H,12-13H2,1-3H3,(H,23,26)