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

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-fluoranyl-benzamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-fluoro-benzamide CAS Name: N-(3-chloro-2-methylphenyl)-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-fluorobenzamide IUPAC Name: N-(3-chloro-2-methylphenyl)-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-fluorobenzamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-fluoro-benzamide Formula: C23H20ClFN2O3S MolecularWeight: 458.932903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3)F

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3)F

InChI

InChI=1S/C23H20ClFN2O3S/c1-15-20(24)7-4-8-22(15)26-23(28)19-13-18(9-10-21(19)25)31(29,30)27-12-11-16-5-2-3-6-17(16)14-27/h2-10,13H,11-12,14H2,1H3,(H,26,28)