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

Systemtic Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-fluoranyl-N-(3-fluoranyl-4-methyl-phenyl)benzamide Openeye Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-fluoro-N-(3-fluoro-4-methyl-phenyl)benzamide CAS Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-fluoro-N-(3-fluoro-4-methylphenyl)benzamide IUPAC Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-fluoro-N-(3-fluoro-4-methylphenyl)benzamide Traditional Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-fluoro-N-(3-fluoro-4-methyl-phenyl)benzamide Formula: C23H20F2N2O3S MolecularWeight: 442.478306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3)F)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3)F)F

InChI

InChI=1S/C23H20F2N2O3S/c1-15-6-7-18(12-22(15)25)26-23(28)20-13-19(8-9-21(20)24)31(29,30)27-11-10-16-4-2-3-5-17(16)14-27/h2-9,12-13H,10-11,14H2,1H3,(H,26,28)