3-(5-bromanylpyridin-2-yl)-1-(4-ethylpiperazin-1-yl)isoquinoline

Systemtic Name: 3-(5-bromanylpyridin-2-yl)-1-(4-ethylpiperazin-1-yl)isoquinoline Openeye Name: 3-(5-bromo-2-pyridyl)-1-(4-ethylpiperazin-1-yl)isoquinoline CAS Name: 3-(5-bromo-2-pyridinyl)-1-(4-ethyl-1-piperazinyl)isoquinoline IUPAC Name: 3-(5-bromopyridin-2-yl)-1-(4-ethylpiperazin-1-yl)isoquinoline Traditional Name: 3-(5-bromo-2-pyridyl)-1-(4-ethylpiperazino)isoquinoline Formula: C20H21BrN4 MolecularWeight: 397.31154

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=NC=C(C=C4)Br

Isomeric SMILES

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=NC=C(C=C4)Br

InChI

InChI=1S/C20H21BrN4/c1-2-24-9-11-25(12-10-24)20-17-6-4-3-5-15(17)13-19(23-20)18-8-7-16(21)14-22-18/h3-8,13-14H,2,9-12H2,1H3