4-(4-bromanylpyrazol-1-yl)-N-[[2-(dimethylaminomethyl)phenyl]methyl]benzamide

Systemtic Name: 4-(4-bromanylpyrazol-1-yl)-N-[[2-(dimethylaminomethyl)phenyl]methyl]benzamide Openeye Name: 4-(4-bromopyrazol-1-yl)-N-[[2-(dimethylaminomethyl)phenyl]methyl]benzamide CAS Name: 4-(4-bromo-1-pyrazolyl)-N-[[2-(dimethylaminomethyl)phenyl]methyl]benzamide IUPAC Name: 4-(4-bromopyrazol-1-yl)-N-[[2-(dimethylaminomethyl)phenyl]methyl]benzamide Traditional Name: 4-(4-bromopyrazol-1-yl)-N-[2-(dimethylaminomethyl)benzyl]benzamide Formula: C20H21BrN4O MolecularWeight: 413.31094

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC=CC=C1CNC(=O)C2=CC=C(C=C2)N3C=C(C=N3)Br

Isomeric SMILES

CN(C)CC1=CC=CC=C1CNC(=O)C2=CC=C(C=C2)N3C=C(C=N3)Br

InChI

InChI=1S/C20H21BrN4O/c1-24(2)13-17-6-4-3-5-16(17)11-22-20(26)15-7-9-19(10-8-15)25-14-18(21)12-23-25/h3-10,12,14H,11,13H2,1-2H3,(H,22,26)