1-[(4-bromanylphenoxy)methyl]-N-(pyridin-2-ylmethyl)pyrazole-3-carboxamide

Systemtic Name: 1-[(4-bromanylphenoxy)methyl]-N-(pyridin-2-ylmethyl)pyrazole-3-carboxamide Openeye Name: 1-[(4-bromophenoxy)methyl]-N-(2-pyridylmethyl)pyrazole-3-carboxamide CAS Name: 1-[(4-bromophenoxy)methyl]-N-(2-pyridinylmethyl)-3-pyrazolecarboxamide IUPAC Name: 1-[(4-bromophenoxy)methyl]-N-(pyridin-2-ylmethyl)pyrazole-3-carboxamide Traditional Name: 1-[(4-bromophenoxy)methyl]-N-(2-pyridylmethyl)pyrazole-3-carboxamide Formula: C17H15BrN4O2 MolecularWeight: 387.2306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CNC(=O)C2=NN(C=C2)COC3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=NC(=C1)CNC(=O)C2=NN(C=C2)COC3=CC=C(C=C3)Br

InChI

InChI=1S/C17H15BrN4O2/c18-13-4-6-15(7-5-13)24-12-22-10-8-16(21-22)17(23)20-11-14-3-1-2-9-19-14/h1-10H,11-12H2,(H,20,23)