3-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-N-prop-2-enyl-benzamide

Systemtic Name: 3-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-N-prop-2-enyl-benzamide Openeye Name: N-allyl-3-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]benzamide CAS Name: 3-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]-N-prop-2-enylbenzamide IUPAC Name: 3-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-N-prop-2-enylbenzamide Traditional Name: N-allyl-3-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]benzamide Formula: C16H18BrN3O MolecularWeight: 348.23762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC(=C2)C(=O)NCC=C)C)Br

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC(=C2)C(=O)NCC=C)C)Br

InChI

InChI=1S/C16H18BrN3O/c1-4-8-18-16(21)14-7-5-6-13(9-14)10-20-12(3)15(17)11(2)19-20/h4-7,9H,1,8,10H2,2-3H3,(H,18,21)