3-(6-butylpyridin-3-yl)-1-(4-ethylpiperazin-1-yl)isoquinoline

Systemtic Name: 3-(6-butylpyridin-3-yl)-1-(4-ethylpiperazin-1-yl)isoquinoline Openeye Name: 3-(6-butyl-3-pyridyl)-1-(4-ethylpiperazin-1-yl)isoquinoline CAS Name: 3-(6-butyl-3-pyridinyl)-1-(4-ethyl-1-piperazinyl)isoquinoline IUPAC Name: 3-(6-butylpyridin-3-yl)-1-(4-ethylpiperazin-1-yl)isoquinoline Traditional Name: 3-(6-butyl-3-pyridyl)-1-(4-ethylpiperazino)isoquinoline Formula: C24H30N4 MolecularWeight: 374.5218

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC=C(C=C1)C2=CC3=CC=CC=C3C(=N2)N4CCN(CC4)CC

Isomeric SMILES

CCCCC1=NC=C(C=C1)C2=CC3=CC=CC=C3C(=N2)N4CCN(CC4)CC

InChI

InChI=1S/C24H30N4/c1-3-5-9-21-12-11-20(18-25-21)23-17-19-8-6-7-10-22(19)24(26-23)28-15-13-27(4-2)14-16-28/h6-8,10-12,17-18H,3-5,9,13-16H2,1-2H3