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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=C(C=C2)C(=O)NCC3=CC(=CC=C3)COC)C)Br

Isomeric SMILES

CC1=C(C(=NN1C2=CC=C(C=C2)C(=O)NCC3=CC(=CC=C3)COC)C)Br

InChI

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