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

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-fluoranyl-benzamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-fluoro-benzamide CAS Name: N-(3-chloro-4-methylphenyl)-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-fluorobenzamide IUPAC Name: N-(3-chloro-4-methylphenyl)-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-fluorobenzamide Traditional Name: N-(3-chloro-4-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=C(C=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3)F)Cl

Isomeric SMILES

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

InChI

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