N-(2-thiophen-2-ylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)-2-(trifluoromethyl)benzamide

Systemtic Name: N-(2-thiophen-2-ylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)-2-(trifluoromethyl)benzamide Openeye Name: N-[2-(2-thienylsulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-2-(trifluoromethyl)benzamide CAS Name: N-(2-thiophen-2-ylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)-2-(trifluoromethyl)benzamide IUPAC Name: N-(2-thiophen-2-ylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)-2-(trifluoromethyl)benzamide Traditional Name: N-[2-(2-thienylsulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-2-(trifluoromethyl)benzamide Formula: C21H17F3N2O3S2 MolecularWeight: 466.49649

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C=CC(=C2)NC(=O)C3=CC=CC=C3C(F)(F)F)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CC2=C1C=CC(=C2)NC(=O)C3=CC=CC=C3C(F)(F)F)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C21H17F3N2O3S2/c22-21(23,24)18-5-2-1-4-17(18)20(27)25-16-8-7-14-9-10-26(13-15(14)12-16)31(28,29)19-6-3-11-30-19/h1-8,11-12H,9-10,13H2,(H,25,27)