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

Systemtic Name: 4-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(pyridin-3-ylmethyl)benzamide Openeye Name: 4-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(3-pyridylmethyl)benzamide CAS Name: 4-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]-N-(3-pyridinylmethyl)benzamide IUPAC Name: 4-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-N-(pyridin-3-ylmethyl)benzamide Traditional Name: 4-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(3-pyridylmethyl)benzamide Formula: C19H19BrN4O MolecularWeight: 399.28436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NCC3=CN=CC=C3)C)Br

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NCC3=CN=CC=C3)C)Br

InChI

InChI=1S/C19H19BrN4O/c1-13-18(20)14(2)24(23-13)12-15-5-7-17(8-6-15)19(25)22-11-16-4-3-9-21-10-16/h3-10H,11-12H2,1-2H3,(H,22,25)