4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]-N-methyl-N-(2-phenylmethoxyethyl)benzamide

Systemtic Name: 4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]-N-methyl-N-(2-phenylmethoxyethyl)benzamide Openeye Name: N-(2-benzyloxyethyl)-4-[1-(4-ethylpiperazin-1-yl)-3-isoquinolyl]-N-methyl-benzamide CAS Name: 4-[1-(4-ethyl-1-piperazinyl)-3-isoquinolinyl]-N-methyl-N-(2-phenylmethoxyethyl)benzamide IUPAC Name: 4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]-N-methyl-N-(2-phenylmethoxyethyl)benzamide Traditional Name: N-(2-benzoxyethyl)-4-[1-(4-ethylpiperazino)-3-isoquinolyl]-N-methyl-benzamide Formula: C32H36N4O2 MolecularWeight: 508.65384

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=CC=C(C=C4)C(=O)N(C)CCOCC5=CC=CC=C5

Isomeric SMILES

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=CC=C(C=C4)C(=O)N(C)CCOCC5=CC=CC=C5

InChI

InChI=1S/C32H36N4O2/c1-3-35-17-19-36(20-18-35)31-29-12-8-7-11-28(29)23-30(33-31)26-13-15-27(16-14-26)32(37)34(2)21-22-38-24-25-9-5-4-6-10-25/h4-16,23H,3,17-22,24H2,1-2H3