3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-N-ethyl-N-(4-fluorophenyl)-4-oxidanylidene-1H-quinoline-6-sulfonamide

Systemtic Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-N-ethyl-N-(4-fluorophenyl)-4-oxidanylidene-1H-quinoline-6-sulfonamide Openeye Name: 3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-N-ethyl-N-(4-fluorophenyl)-4-oxo-1H-quinoline-6-sulfonamide CAS Name: 3-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-N-ethyl-N-(4-fluorophenyl)-4-oxo-1H-quinoline-6-sulfonamide IUPAC Name: 3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-N-ethyl-N-(4-fluorophenyl)-4-oxo-1H-quinoline-6-sulfonamide Traditional Name: 3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-N-ethyl-N-(4-fluorophenyl)-4-keto-1H-quinoline-6-sulfonamide Formula: C27H24FN3O4S MolecularWeight: 505.560563

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=C(C=C1)F)S(=O)(=O)C2=CC3=C(C=C2)NC=C(C3=O)C(=O)N4CCC5=CC=CC=C5C4

Isomeric SMILES

CCN(C1=CC=C(C=C1)F)S(=O)(=O)C2=CC3=C(C=C2)NC=C(C3=O)C(=O)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C27H24FN3O4S/c1-2-31(21-9-7-20(28)8-10-21)36(34,35)22-11-12-25-23(15-22)26(32)24(16-29-25)27(33)30-14-13-18-5-3-4-6-19(18)17-30/h3-12,15-16H,2,13-14,17H2,1H3,(H,29,32)