1-[4-[4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]phenyl]piperazin-1-yl]ethanone

Systemtic Name: 1-[4-[4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]phenyl]piperazin-1-yl]ethanone Openeye Name: 1-[4-[4-[1-(4-ethylpiperazin-1-yl)-3-isoquinolyl]phenyl]piperazin-1-yl]ethanone CAS Name: 1-[4-[4-[1-(4-ethyl-1-piperazinyl)-3-isoquinolinyl]phenyl]-1-piperazinyl]ethanone IUPAC Name: 1-[4-[4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]phenyl]piperazin-1-yl]ethanone Traditional Name: 1-[4-[4-[1-(4-ethylpiperazino)-3-isoquinolyl]phenyl]piperazino]ethanone Formula: C27H33N5O MolecularWeight: 443.58382

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=CC=C(C=C4)N5CCN(CC5)C(=O)C

Isomeric SMILES

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=CC=C(C=C4)N5CCN(CC5)C(=O)C

InChI

InChI=1S/C27H33N5O/c1-3-29-12-14-32(15-13-29)27-25-7-5-4-6-23(25)20-26(28-27)22-8-10-24(11-9-22)31-18-16-30(17-19-31)21(2)33/h4-11,20H,3,12-19H2,1-2H3