1-[(4-bromanylphenoxy)methyl]-N-[1-[(2-chlorophenyl)methyl]pyrazol-4-yl]pyrazole-3-carboxamide

Systemtic Name: 1-[(4-bromanylphenoxy)methyl]-N-[1-[(2-chlorophenyl)methyl]pyrazol-4-yl]pyrazole-3-carboxamide Openeye Name: 1-[(4-bromophenoxy)methyl]-N-[1-[(2-chlorophenyl)methyl]pyrazol-4-yl]pyrazole-3-carboxamide CAS Name: 1-[(4-bromophenoxy)methyl]-N-[1-[(2-chlorophenyl)methyl]-4-pyrazolyl]-3-pyrazolecarboxamide IUPAC Name: 1-[(4-bromophenoxy)methyl]-N-[1-[(2-chlorophenyl)methyl]pyrazol-4-yl]pyrazole-3-carboxamide Traditional Name: 1-[(4-bromophenoxy)methyl]-N-[1-(2-chlorobenzyl)pyrazol-4-yl]pyrazole-3-carboxamide Formula: C21H17BrClN5O2 MolecularWeight: 486.74898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C=C(C=N2)NC(=O)C3=NN(C=C3)COC4=CC=C(C=C4)Br)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CN2C=C(C=N2)NC(=O)C3=NN(C=C3)COC4=CC=C(C=C4)Br)Cl

InChI

InChI=1S/C21H17BrClN5O2/c22-16-5-7-18(8-6-16)30-14-27-10-9-20(26-27)21(29)25-17-11-24-28(13-17)12-15-3-1-2-4-19(15)23/h1-11,13H,12,14H2,(H,25,29)