(3R)-2-(4-fluorophenyl)sulfonyl-N-[(5-methylfuran-2-yl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: (3R)-2-(4-fluorophenyl)sulfonyl-N-[(5-methylfuran-2-yl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: (3R)-2-(4-fluorophenyl)sulfonyl-N-[(5-methyl-2-furyl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: (3R)-2-(4-fluorophenyl)sulfonyl-N-[(5-methyl-2-furanyl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: (3R)-2-(4-fluorophenyl)sulfonyl-N-[(5-methylfuran-2-yl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: (3R)-2-(4-fluorophenyl)sulfonyl-N-[(5-methyl-2-furyl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C22H21FN2O4S MolecularWeight: 428.476543

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CNC(=O)C2CC3=CC=CC=C3CN2S(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC=C(O1)CNC(=O)[C@H]2CC3=CC=CC=C3CN2S(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H21FN2O4S/c1-15-6-9-19(29-15)13-24-22(26)21-12-16-4-2-3-5-17(16)14-25(21)30(27,28)20-10-7-18(23)8-11-20/h2-11,21H,12-14H2,1H3,(H,24,26)/t21-/m1/s1