4-(4-chlorophenyl)-N-isoquinolin-5-yl-piperazine-1-carboxamide

Systemtic Name: 4-(4-chlorophenyl)-N-isoquinolin-5-yl-piperazine-1-carboxamide Openeye Name: 4-(4-chlorophenyl)-N-(5-isoquinolyl)piperazine-1-carboxamide CAS Name: 4-(4-chlorophenyl)-N-(5-isoquinolinyl)-1-piperazinecarboxamide IUPAC Name: 4-(4-chlorophenyl)-N-isoquinolin-5-ylpiperazine-1-carboxamide Traditional Name: 4-(4-chlorophenyl)-N-(5-isoquinolyl)piperazine-1-carboxamide Formula: C20H19ClN4O MolecularWeight: 366.84406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)Cl)C(=O)NC3=CC=CC4=C3C=CN=C4

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)Cl)C(=O)NC3=CC=CC4=C3C=CN=C4

InChI

InChI=1S/C20H19ClN4O/c21-16-4-6-17(7-5-16)24-10-12-25(13-11-24)20(26)23-19-3-1-2-15-14-22-9-8-18(15)19/h1-9,14H,10-13H2,(H,23,26)