4-[2,3-bis(chloranyl)phenyl]-N-isoquinolin-5-yl-piperazine-1-carboxamide

Systemtic Name: 4-[2,3-bis(chloranyl)phenyl]-N-isoquinolin-5-yl-piperazine-1-carboxamide Openeye Name: 4-(2,3-dichlorophenyl)-N-(5-isoquinolyl)piperazine-1-carboxamide CAS Name: 4-(2,3-dichlorophenyl)-N-(5-isoquinolinyl)-1-piperazinecarboxamide IUPAC Name: 4-(2,3-dichlorophenyl)-N-isoquinolin-5-ylpiperazine-1-carboxamide Traditional Name: 4-(2,3-dichlorophenyl)-N-(5-isoquinolyl)piperazine-1-carboxamide Formula: C20H18Cl2N4O MolecularWeight: 401.28912

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18Cl2N4O/c21-16-4-2-6-18(19(16)22)25-9-11-26(12-10-25)20(27)24-17-5-1-3-14-13-23-8-7-15(14)17/h1-8,13H,9-12H2,(H,24,27)