2-[2,6-bis(fluoranyl)phenyl]sulfonyl-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: 2-[2,6-bis(fluoranyl)phenyl]sulfonyl-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-(2,6-difluorophenyl)sulfonyl-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-(2,6-difluorophenyl)sulfonyl-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-(2,6-difluorophenyl)sulfonyl-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-(2,6-difluorophenyl)sulfonyl-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C17H16F2N2O3S MolecularWeight: 366.382346

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1CC2=CC=CC=C2CN1S(=O)(=O)C3=C(C=CC=C3F)F

Isomeric SMILES

CNC(=O)C1CC2=CC=CC=C2CN1S(=O)(=O)C3=C(C=CC=C3F)F

InChI

InChI=1S/C17H16F2N2O3S/c1-20-17(22)15-9-11-5-2-3-6-12(11)10-21(15)25(23,24)16-13(18)7-4-8-14(16)19/h2-8,15H,9-10H2,1H3,(H,20,22)