2-chloranyl-N-(2-chloranyl-4-fluoranyl-phenyl)-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide

Systemtic Name: 2-chloranyl-N-(2-chloranyl-4-fluoranyl-phenyl)-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide Openeye Name: 2-chloro-N-(2-chloro-4-fluoro-phenyl)-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide CAS Name: 2-chloro-N-(2-chloro-4-fluorophenyl)-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide IUPAC Name: 2-chloro-N-(2-chloro-4-fluorophenyl)-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide Traditional Name: 2-chloro-N-(2-chloro-4-fluoro-phenyl)-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide Formula: C22H17Cl2FN2O3S MolecularWeight: 479.351383

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC(=C(C=C3)Cl)C(=O)NC4=C(C=C(C=C4)F)Cl

Isomeric SMILES

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC(=C(C=C3)Cl)C(=O)NC4=C(C=C(C=C4)F)Cl

InChI

InChI=1S/C22H17Cl2FN2O3S/c23-19-7-6-17(12-18(19)22(28)26-21-8-5-16(25)11-20(21)24)31(29,30)27-10-9-14-3-1-2-4-15(14)13-27/h1-8,11-12H,9-10,13H2,(H,26,28)