2-(4-fluorophenyl)sulfonyl-N-[(2,4,6-trimethoxyphenyl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: 2-(4-fluorophenyl)sulfonyl-N-[(2,4,6-trimethoxyphenyl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-(4-fluorophenyl)sulfonyl-N-[(2,4,6-trimethoxyphenyl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-(4-fluorophenyl)sulfonyl-N-[(2,4,6-trimethoxyphenyl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-(4-fluorophenyl)sulfonyl-N-[(2,4,6-trimethoxyphenyl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-(4-fluorophenyl)sulfonyl-N-(2,4,6-trimethoxybenzyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C26H27FN2O6S MolecularWeight: 514.565783

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C(=C1)OC)CNC(=O)C2CC3=CC=CC=C3CN2S(=O)(=O)C4=CC=C(C=C4)F)OC

Isomeric SMILES

COC1=CC(=C(C(=C1)OC)CNC(=O)C2CC3=CC=CC=C3CN2S(=O)(=O)C4=CC=C(C=C4)F)OC

InChI

InChI=1S/C26H27FN2O6S/c1-33-20-13-24(34-2)22(25(14-20)35-3)15-28-26(30)23-12-17-6-4-5-7-18(17)16-29(23)36(31,32)21-10-8-19(27)9-11-21/h4-11,13-14,23H,12,15-16H2,1-3H3,(H,28,30)