4-(3,4-dichlorophenyl)-N-(3-methylisoquinolin-5-yl)piperazine-1-carboxamide

Systemtic Name: 4-(3,4-dichlorophenyl)-N-(3-methylisoquinolin-5-yl)piperazine-1-carboxamide Openeye Name: 4-(3,4-dichlorophenyl)-N-(3-methyl-5-isoquinolyl)piperazine-1-carboxamide CAS Name: 4-(3,4-dichlorophenyl)-N-(3-methyl-5-isoquinolinyl)-1-piperazinecarboxamide IUPAC Name: 4-(3,4-dichlorophenyl)-N-(3-methylisoquinolin-5-yl)piperazine-1-carboxamide Traditional Name: 4-(3,4-dichlorophenyl)-N-(3-methyl-5-isoquinolyl)piperazine-1-carboxamide Formula: C21H20Cl2N4O MolecularWeight: 415.3157

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C2C=CC=C(C2=C1)NC(=O)N3CCN(CC3)C4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

CC1=NC=C2C=CC=C(C2=C1)NC(=O)N3CCN(CC3)C4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C21H20Cl2N4O/c1-14-11-17-15(13-24-14)3-2-4-20(17)25-21(28)27-9-7-26(8-10-27)16-5-6-18(22)19(23)12-16/h2-6,11-13H,7-10H2,1H3,(H,25,28)