N-[1-[(4-bromanylphenoxy)methyl]pyrazol-4-yl]-3-(4-bromanylpyrazol-1-yl)propanamide

Systemtic Name: N-[1-[(4-bromanylphenoxy)methyl]pyrazol-4-yl]-3-(4-bromanylpyrazol-1-yl)propanamide Openeye Name: N-[1-[(4-bromophenoxy)methyl]pyrazol-4-yl]-3-(4-bromopyrazol-1-yl)propanamide CAS Name: N-[1-[(4-bromophenoxy)methyl]-4-pyrazolyl]-3-(4-bromo-1-pyrazolyl)propanamide IUPAC Name: N-[1-[(4-bromophenoxy)methyl]pyrazol-4-yl]-3-(4-bromopyrazol-1-yl)propanamide Traditional Name: N-[1-[(4-bromophenoxy)methyl]pyrazol-4-yl]-3-(4-bromopyrazol-1-yl)propionamide Formula: C16H15Br2N5O2 MolecularWeight: 469.1306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCN2C=C(C=N2)NC(=O)CCN3C=C(C=N3)Br)Br

Isomeric SMILES

C1=CC(=CC=C1OCN2C=C(C=N2)NC(=O)CCN3C=C(C=N3)Br)Br

InChI

InChI=1S/C16H15Br2N5O2/c17-12-1-3-15(4-2-12)25-11-23-10-14(8-20-23)21-16(24)5-6-22-9-13(18)7-19-22/h1-4,7-10H,5-6,11H2,(H,21,24)