3-bromanyl-N-[(1,3-dimethylpyrazol-4-yl)methyl]benzamide

Systemtic Name: 3-bromanyl-N-[(1,3-dimethylpyrazol-4-yl)methyl]benzamide Openeye Name: 3-bromo-N-[(1,3-dimethylpyrazol-4-yl)methyl]benzamide CAS Name: 3-bromo-N-[(1,3-dimethyl-4-pyrazolyl)methyl]benzamide IUPAC Name: 3-bromo-N-[(1,3-dimethylpyrazol-4-yl)methyl]benzamide Traditional Name: 3-bromo-N-[(1,3-dimethylpyrazol-4-yl)methyl]benzamide Formula: C13H14BrN3O MolecularWeight: 308.17376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1CNC(=O)C2=CC(=CC=C2)Br)C

Isomeric SMILES

CC1=NN(C=C1CNC(=O)C2=CC(=CC=C2)Br)C

InChI

InChI=1S/C13H14BrN3O/c1-9-11(8-17(2)16-9)7-15-13(18)10-4-3-5-12(14)6-10/h3-6,8H,7H2,1-2H3,(H,15,18)