6-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[(4-fluorophenyl)methyl]-4-oxidanylidene-1H-quinoline-3-carboxamide

Systemtic Name: 6-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[(4-fluorophenyl)methyl]-4-oxidanylidene-1H-quinoline-3-carboxamide Openeye Name: 6-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[(4-fluorophenyl)methyl]-4-oxo-1H-quinoline-3-carboxamide CAS Name: 6-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[(4-fluorophenyl)methyl]-4-oxo-1H-quinoline-3-carboxamide IUPAC Name: 6-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[(4-fluorophenyl)methyl]-4-oxo-1H-quinoline-3-carboxamide Traditional Name: 6-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(4-fluorobenzyl)-4-keto-1H-quinoline-3-carboxamide Formula: C26H22FN3O4S MolecularWeight: 491.533983

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC4=C(C=C3)NC=C(C4=O)C(=O)NCC5=CC=C(C=C5)F

Isomeric SMILES

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC4=C(C=C3)NC=C(C4=O)C(=O)NCC5=CC=C(C=C5)F

InChI

InChI=1S/C26H22FN3O4S/c27-20-7-5-17(6-8-20)14-29-26(32)23-15-28-24-10-9-21(13-22(24)25(23)31)35(33,34)30-12-11-18-3-1-2-4-19(18)16-30/h1-10,13,15H,11-12,14,16H2,(H,28,31)(H,29,32)