N-[2-fluoranyl-4-[(2-thiophen-2-ylcarbonyl-3,4-dihydro-1H-isoquinolin-7-yl)sulfamoyl]phenyl]ethanamide

Systemtic Name: N-[2-fluoranyl-4-[(2-thiophen-2-ylcarbonyl-3,4-dihydro-1H-isoquinolin-7-yl)sulfamoyl]phenyl]ethanamide Openeye Name: N-[2-fluoro-4-[[2-(thiophene-2-carbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]sulfamoyl]phenyl]acetamide CAS Name: N-[2-fluoro-4-[[2-[oxo(thiophen-2-yl)methyl]-3,4-dihydro-1H-isoquinolin-7-yl]sulfamoyl]phenyl]acetamide IUPAC Name: N-[2-fluoro-4-[[2-(thiophene-2-carbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]sulfamoyl]phenyl]acetamide Traditional Name: N-[2-fluoro-4-[[2-(2-thenoyl)-3,4-dihydro-1H-isoquinolin-7-yl]sulfamoyl]phenyl]acetamide Formula: C22H20FN3O4S2 MolecularWeight: 473.540303

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)S(=O)(=O)NC2=CC3=C(CCN(C3)C(=O)C4=CC=CS4)C=C2)F

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)S(=O)(=O)NC2=CC3=C(CCN(C3)C(=O)C4=CC=CS4)C=C2)F

InChI

InChI=1S/C22H20FN3O4S2/c1-14(27)24-20-7-6-18(12-19(20)23)32(29,30)25-17-5-4-15-8-9-26(13-16(15)11-17)22(28)21-3-2-10-31-21/h2-7,10-12,25H,8-9,13H2,1H3,(H,24,27)