(3R)-N-(4-bromanyl-3-methyl-phenyl)-2-(2-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: (3R)-N-(4-bromanyl-3-methyl-phenyl)-2-(2-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: (3R)-N-(4-bromo-3-methyl-phenyl)-2-(2-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: (3R)-N-(4-bromo-3-methylphenyl)-2-(2-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: (3R)-N-(4-bromo-3-methylphenyl)-2-(2-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: (3R)-N-(4-bromo-3-methyl-phenyl)-2-(2-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C23H20BrFN2O3S MolecularWeight: 503.383903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2CC3=CC=CC=C3CN2S(=O)(=O)C4=CC=CC=C4F)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)[C@H]2CC3=CC=CC=C3CN2S(=O)(=O)C4=CC=CC=C4F)Br

InChI

InChI=1S/C23H20BrFN2O3S/c1-15-12-18(10-11-19(15)24)26-23(28)21-13-16-6-2-3-7-17(16)14-27(21)31(29,30)22-9-5-4-8-20(22)25/h2-12,21H,13-14H2,1H3,(H,26,28)/t21-/m1/s1