4-(4-isoquinolin-4-ylpiperazin-1-yl)-N,N-dimethyl-2,2-diphenyl-butanamide

Systemtic Name: 4-(4-isoquinolin-4-ylpiperazin-1-yl)-N,N-dimethyl-2,2-diphenyl-butanamide Openeye Name: 4-[4-(4-isoquinolyl)piperazin-1-yl]-N,N-dimethyl-2,2-diphenyl-butanamide CAS Name: 4-[4-(4-isoquinolinyl)-1-piperazinyl]-N,N-dimethyl-2,2-diphenylbutanamide IUPAC Name: 4-(4-isoquinolin-4-ylpiperazin-1-yl)-N,N-dimethyl-2,2-diphenylbutanamide Traditional Name: 4-[4-(4-isoquinolyl)piperazino]-N,N-dimethyl-2,2-diphenyl-butyramide Formula: C31H34N4O MolecularWeight: 478.62786

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C(CCN1CCN(CC1)C2=CN=CC3=CC=CC=C32)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CN(C)C(=O)C(CCN1CCN(CC1)C2=CN=CC3=CC=CC=C32)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H34N4O/c1-33(2)30(36)31(26-12-5-3-6-13-26,27-14-7-4-8-15-27)17-18-34-19-21-35(22-20-34)29-24-32-23-25-11-9-10-16-28(25)29/h3-16,23-24H,17-22H2,1-2H3