N-[3-[(4-bromanylpyrazol-1-yl)methyl]phenyl]-1-[(4-methoxyphenoxy)methyl]pyrazole-3-carboxamide

Systemtic Name: N-[3-[(4-bromanylpyrazol-1-yl)methyl]phenyl]-1-[(4-methoxyphenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-1-[(4-methoxyphenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-[3-[(4-bromo-1-pyrazolyl)methyl]phenyl]-1-[(4-methoxyphenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-1-[(4-methoxyphenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-1-[(4-methoxyphenoxy)methyl]pyrazole-3-carboxamide Formula: C22H20BrN5O3 MolecularWeight: 482.3299

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCN2C=CC(=N2)C(=O)NC3=CC=CC(=C3)CN4C=C(C=N4)Br

Isomeric SMILES

COC1=CC=C(C=C1)OCN2C=CC(=N2)C(=O)NC3=CC=CC(=C3)CN4C=C(C=N4)Br

InChI

InChI=1S/C22H20BrN5O3/c1-30-19-5-7-20(8-6-19)31-15-27-10-9-21(26-27)22(29)25-18-4-2-3-16(11-18)13-28-14-17(23)12-24-28/h2-12,14H,13,15H2,1H3,(H,25,29)