N-[[5-(3-methoxyphenyl)isoquinolin-8-yl]methyl]-3-(trifluoromethyl)benzenesulfonamide

Systemtic Name: N-[[5-(3-methoxyphenyl)isoquinolin-8-yl]methyl]-3-(trifluoromethyl)benzenesulfonamide Openeye Name: N-[[5-(3-methoxyphenyl)-8-isoquinolyl]methyl]-3-(trifluoromethyl)benzenesulfonamide CAS Name: N-[[5-(3-methoxyphenyl)-8-isoquinolinyl]methyl]-3-(trifluoromethyl)benzenesulfonamide IUPAC Name: N-[[5-(3-methoxyphenyl)isoquinolin-8-yl]methyl]-3-(trifluoromethyl)benzenesulfonamide Traditional Name: N-[[5-(3-methoxyphenyl)-8-isoquinolyl]methyl]-3-(trifluoromethyl)benzenesulfonamide Formula: C24H19F3N2O3S MolecularWeight: 472.47947

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=C3C=CN=CC3=C(C=C2)CNS(=O)(=O)C4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

COC1=CC=CC(=C1)C2=C3C=CN=CC3=C(C=C2)CNS(=O)(=O)C4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C24H19F3N2O3S/c1-32-19-6-2-4-16(12-19)21-9-8-17(23-15-28-11-10-22(21)23)14-29-33(30,31)20-7-3-5-18(13-20)24(25,26)27/h2-13,15,29H,14H2,1H3