5-bromanyl-N-[5-chloranyl-2-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]pyridine-3-carboxamide

Systemtic Name: 5-bromanyl-N-[5-chloranyl-2-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]pyridine-3-carboxamide Openeye Name: 5-bromo-N-[5-chloro-2-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]pyridine-3-carboxamide CAS Name: 5-bromo-N-[5-chloro-2-[4-[(E)-1-oxo-3-phenylprop-2-enyl]-1-piperazinyl]phenyl]-3-pyridinecarboxamide IUPAC Name: 5-bromo-N-[5-chloro-2-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]pyridine-3-carboxamide Traditional Name: 5-bromo-N-[5-chloro-2-[4-[(E)-3-phenylacryloyl]piperazino]phenyl]nicotinamide Formula: C25H22BrClN4O2 MolecularWeight: 525.82478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)Cl)NC(=O)C3=CC(=CN=C3)Br)C(=O)C=CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)Cl)NC(=O)C3=CC(=CN=C3)Br)C(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C25H22BrClN4O2/c26-20-14-19(16-28-17-20)25(33)29-22-15-21(27)7-8-23(22)30-10-12-31(13-11-30)24(32)9-6-18-4-2-1-3-5-18/h1-9,14-17H,10-13H2,(H,29,33)/b9-6+