2-(4-chloranyl-2-fluoranyl-phenyl)sulfonyl-N-isoquinolin-3-yl-2-methyl-propanamide

Systemtic Name: 2-(4-chloranyl-2-fluoranyl-phenyl)sulfonyl-N-isoquinolin-3-yl-2-methyl-propanamide Openeye Name: 2-(4-chloro-2-fluoro-phenyl)sulfonyl-N-(3-isoquinolyl)-2-methyl-propanamide CAS Name: 2-(4-chloro-2-fluorophenyl)sulfonyl-N-(3-isoquinolinyl)-2-methylpropanamide IUPAC Name: 2-(4-chloro-2-fluorophenyl)sulfonyl-N-isoquinolin-3-yl-2-methylpropanamide Traditional Name: 2-(4-chloro-2-fluoro-phenyl)sulfonyl-N-(3-isoquinolyl)-2-methyl-propionamide Formula: C19H16ClFN2O3S MolecularWeight: 406.858343

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NC1=CC2=CC=CC=C2C=N1)S(=O)(=O)C3=C(C=C(C=C3)Cl)F

Isomeric SMILES

CC(C)(C(=O)NC1=CC2=CC=CC=C2C=N1)S(=O)(=O)C3=C(C=C(C=C3)Cl)F

InChI

InChI=1S/C19H16ClFN2O3S/c1-19(2,27(25,26)16-8-7-14(20)10-15(16)21)18(24)23-17-9-12-5-3-4-6-13(12)11-22-17/h3-11H,1-2H3,(H,22,23,24)