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

Systemtic Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-fluoranyl-N-(3-fluorophenyl)benzamide Openeye Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-fluoro-N-(3-fluorophenyl)benzamide CAS Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-fluoro-N-(3-fluorophenyl)benzamide IUPAC Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-fluoro-N-(3-fluorophenyl)benzamide Traditional Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-fluoro-N-(3-fluorophenyl)benzamide Formula: C22H18F2N2O3S MolecularWeight: 428.451726

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H18F2N2O3S/c23-17-6-3-7-18(12-17)25-22(27)20-13-19(8-9-21(20)24)30(28,29)26-11-10-15-4-1-2-5-16(15)14-26/h1-9,12-13H,10-11,14H2,(H,25,27)