2-(2-bromanyl-4,5-dimethoxy-phenyl)-1-(4-pyrazin-2-ylpiperazin-1-yl)ethanone

Systemtic Name: 2-(2-bromanyl-4,5-dimethoxy-phenyl)-1-(4-pyrazin-2-ylpiperazin-1-yl)ethanone Openeye Name: 2-(2-bromo-4,5-dimethoxy-phenyl)-1-(4-pyrazin-2-ylpiperazin-1-yl)ethanone CAS Name: 2-(2-bromo-4,5-dimethoxyphenyl)-1-[4-(2-pyrazinyl)-1-piperazinyl]ethanone IUPAC Name: 2-(2-bromo-4,5-dimethoxyphenyl)-1-(4-pyrazin-2-ylpiperazin-1-yl)ethanone Traditional Name: 2-(2-bromo-4,5-dimethoxy-phenyl)-1-(4-pyrazin-2-ylpiperazino)ethanone Formula: C18H21BrN4O3 MolecularWeight: 421.28834

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CC(=O)N2CCN(CC2)C3=NC=CN=C3)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CC(=O)N2CCN(CC2)C3=NC=CN=C3)Br)OC

InChI

InChI=1S/C18H21BrN4O3/c1-25-15-9-13(14(19)11-16(15)26-2)10-18(24)23-7-5-22(6-8-23)17-12-20-3-4-21-17/h3-4,9,11-12H,5-8,10H2,1-2H3