2-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]-N-(3,4,5-trimethoxyphenyl)ethanamide

Systemtic Name: 2-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]-N-(3,4,5-trimethoxyphenyl)ethanamide Openeye Name: 2-[4-(5-bromo-2-pyridyl)piperazin-1-yl]-N-(3,4,5-trimethoxyphenyl)acetamide CAS Name: 2-[4-(5-bromo-2-pyridinyl)-1-piperazinyl]-N-(3,4,5-trimethoxyphenyl)acetamide IUPAC Name: 2-[4-(5-bromopyridin-2-yl)piperazin-1-yl]-N-(3,4,5-trimethoxyphenyl)acetamide Traditional Name: 2-[4-(5-bromo-2-pyridyl)piperazino]-N-(3,4,5-trimethoxyphenyl)acetamide Formula: C20H25BrN4O4 MolecularWeight: 465.3409

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC(=O)CN2CCN(CC2)C3=NC=C(C=C3)Br

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC(=O)CN2CCN(CC2)C3=NC=C(C=C3)Br

InChI

InChI=1S/C20H25BrN4O4/c1-27-16-10-15(11-17(28-2)20(16)29-3)23-19(26)13-24-6-8-25(9-7-24)18-5-4-14(21)12-22-18/h4-5,10-12H,6-9,13H2,1-3H3,(H,23,26)