2-(2-fluorophenyl)sulfonyl-N-(4-iodophenyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: 2-(2-fluorophenyl)sulfonyl-N-(4-iodophenyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-(2-fluorophenyl)sulfonyl-N-(4-iodophenyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-(2-fluorophenyl)sulfonyl-N-(4-iodophenyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-(2-fluorophenyl)sulfonyl-N-(4-iodophenyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-(2-fluorophenyl)sulfonyl-N-(4-iodophenyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C22H18FIN2O3S MolecularWeight: 536.357793

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CC2=CC=CC=C21)S(=O)(=O)C3=CC=CC=C3F)C(=O)NC4=CC=C(C=C4)I

Isomeric SMILES

C1C(N(CC2=CC=CC=C21)S(=O)(=O)C3=CC=CC=C3F)C(=O)NC4=CC=C(C=C4)I

InChI

InChI=1S/C22H18FIN2O3S/c23-19-7-3-4-8-21(19)30(28,29)26-14-16-6-2-1-5-15(16)13-20(26)22(27)25-18-11-9-17(24)10-12-18/h1-12,20H,13-14H2,(H,25,27)