4-chloranyl-N-[1-(4-methylpiperazin-1-yl)isoquinolin-7-yl]benzamide

Systemtic Name: 4-chloranyl-N-[1-(4-methylpiperazin-1-yl)isoquinolin-7-yl]benzamide Openeye Name: 4-chloro-N-[1-(4-methylpiperazin-1-yl)-7-isoquinolyl]benzamide CAS Name: 4-chloro-N-[1-(4-methyl-1-piperazinyl)-7-isoquinolinyl]benzamide IUPAC Name: 4-chloro-N-[1-(4-methylpiperazin-1-yl)isoquinolin-7-yl]benzamide Traditional Name: 4-chloro-N-[1-(4-methylpiperazino)-7-isoquinolyl]benzamide Formula: C21H21ClN4O MolecularWeight: 380.87064

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC=CC3=C2C=C(C=C3)NC(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CN1CCN(CC1)C2=NC=CC3=C2C=C(C=C3)NC(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H21ClN4O/c1-25-10-12-26(13-11-25)20-19-14-18(7-4-15(19)8-9-23-20)24-21(27)16-2-5-17(22)6-3-16/h2-9,14H,10-13H2,1H3,(H,24,27)