N-[1-[(4-bromophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-2,6-dimethoxy-benzamide

Systemtic Name: N-[1-[(4-bromophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-2,6-dimethoxy-benzamide Openeye Name: N-[1-[(4-bromophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-2,6-dimethoxy-benzamide CAS Name: N-[1-[(4-bromophenyl)methyl]-3,5-dimethyl-4-pyrazolyl]-2,6-dimethoxybenzamide IUPAC Name: N-[1-[(4-bromophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-2,6-dimethoxybenzamide Traditional Name: N-[1-(4-bromobenzyl)-3,5-dimethyl-pyrazol-4-yl]-2,6-dimethoxy-benzamide Formula: C21H22BrN3O3 MolecularWeight: 444.32168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(C=C2)Br)C)NC(=O)C3=C(C=CC=C3OC)OC

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(C=C2)Br)C)NC(=O)C3=C(C=CC=C3OC)OC

InChI

InChI=1S/C21H22BrN3O3/c1-13-20(14(2)25(24-13)12-15-8-10-16(22)11-9-15)23-21(26)19-17(27-3)6-5-7-18(19)28-4/h5-11H,12H2,1-4H3,(H,23,26)