2-[3,4-bis(fluoranyl)phenyl]sulfonyl-6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-[3,4-bis(fluoranyl)phenyl]sulfonyl-6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinoline Openeye Name: 2-(3,4-difluorophenyl)sulfonyl-6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinoline CAS Name: 2-(3,4-difluorophenyl)sulfonyl-6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-(3,4-difluorophenyl)sulfonyl-6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinoline Traditional Name: 2-(3,4-difluorophenyl)sulfonyl-6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinoline Formula: C21H19F2NO4S2 MolecularWeight: 451.506666

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)S(=O)(=O)C3=CC(=C(C=C3)F)F)C4=CC=CS4)OC

Isomeric SMILES

COC1=C(C=C2C(N(CCC2=C1)S(=O)(=O)C3=CC(=C(C=C3)F)F)C4=CC=CS4)OC

InChI

InChI=1S/C21H19F2NO4S2/c1-27-18-10-13-7-8-24(30(25,26)14-5-6-16(22)17(23)11-14)21(20-4-3-9-29-20)15(13)12-19(18)28-2/h3-6,9-12,21H,7-8H2,1-2H3