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

Systemtic Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-fluoranyl-N-(4-propan-2-ylphenyl)benzamide Openeye Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-fluoro-N-(4-isopropylphenyl)benzamide CAS Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-fluoro-N-(4-propan-2-ylphenyl)benzamide IUPAC Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-fluoro-N-(4-propan-2-ylphenyl)benzamide Traditional Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-fluoro-N-p-cumenyl-benzamide Formula: C25H25FN2O3S MolecularWeight: 452.541003

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H25FN2O3S/c1-17(2)18-7-9-21(10-8-18)27-25(29)23-15-22(11-12-24(23)26)32(30,31)28-14-13-19-5-3-4-6-20(19)16-28/h3-12,15,17H,13-14,16H2,1-2H3,(H,27,29)