5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(2,6-dimethylphenyl)-2-fluoranyl-benzamide

Systemtic Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(2,6-dimethylphenyl)-2-fluoranyl-benzamide Openeye Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(2,6-dimethylphenyl)-2-fluoro-benzamide CAS Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(2,6-dimethylphenyl)-2-fluorobenzamide IUPAC Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(2,6-dimethylphenyl)-2-fluorobenzamide Traditional Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(2,6-dimethylphenyl)-2-fluoro-benzamide Formula: C24H23FN2O3S MolecularWeight: 438.514423

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H23FN2O3S/c1-16-6-5-7-17(2)23(16)26-24(28)21-14-20(10-11-22(21)25)31(29,30)27-13-12-18-8-3-4-9-19(18)15-27/h3-11,14H,12-13,15H2,1-2H3,(H,26,28)