[6-(3-bromanylphenoxy)pyridin-3-yl]-[4-(6-chloranylpyridin-2-yl)piperazin-1-yl]methanone

Systemtic Name: [6-(3-bromanylphenoxy)pyridin-3-yl]-[4-(6-chloranylpyridin-2-yl)piperazin-1-yl]methanone Openeye Name: [6-(3-bromophenoxy)-3-pyridyl]-[4-(6-chloro-2-pyridyl)piperazin-1-yl]methanone CAS Name: [6-(3-bromophenoxy)-3-pyridinyl]-[4-(6-chloro-2-pyridinyl)-1-piperazinyl]methanone IUPAC Name: [6-(3-bromophenoxy)pyridin-3-yl]-[4-(6-chloropyridin-2-yl)piperazin-1-yl]methanone Traditional Name: [6-(3-bromophenoxy)-3-pyridyl]-[4-(6-chloro-2-pyridyl)piperazino]methanone Formula: C21H18BrClN4O2 MolecularWeight: 473.75022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC(=CC=C2)Cl)C(=O)C3=CN=C(C=C3)OC4=CC(=CC=C4)Br

Isomeric SMILES

C1CN(CCN1C2=NC(=CC=C2)Cl)C(=O)C3=CN=C(C=C3)OC4=CC(=CC=C4)Br

InChI

InChI=1S/C21H18BrClN4O2/c22-16-3-1-4-17(13-16)29-20-8-7-15(14-24-20)21(28)27-11-9-26(10-12-27)19-6-2-5-18(23)25-19/h1-8,13-14H,9-12H2