2-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]-N-[(3,4-dimethoxyphenyl)methyl]propanamide

Systemtic Name: 2-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]-N-[(3,4-dimethoxyphenyl)methyl]propanamide Openeye Name: 2-[4-(5-bromo-2-pyridyl)piperazin-1-yl]-N-[(3,4-dimethoxyphenyl)methyl]propanamide CAS Name: 2-[4-(5-bromo-2-pyridinyl)-1-piperazinyl]-N-[(3,4-dimethoxyphenyl)methyl]propanamide IUPAC Name: 2-[4-(5-bromopyridin-2-yl)piperazin-1-yl]-N-[(3,4-dimethoxyphenyl)methyl]propanamide Traditional Name: 2-[4-(5-bromo-2-pyridyl)piperazino]-N-veratryl-propionamide Formula: C21H27BrN4O3 MolecularWeight: 463.36808

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC(=C(C=C1)OC)OC)N2CCN(CC2)C3=NC=C(C=C3)Br

Isomeric SMILES

CC(C(=O)NCC1=CC(=C(C=C1)OC)OC)N2CCN(CC2)C3=NC=C(C=C3)Br

InChI

InChI=1S/C21H27BrN4O3/c1-15(21(27)24-13-16-4-6-18(28-2)19(12-16)29-3)25-8-10-26(11-9-25)20-7-5-17(22)14-23-20/h4-7,12,14-15H,8-11,13H2,1-3H3,(H,24,27)