1-[4-methyl-4-(5-methylsulfonyl-2,3-dihydro-1-benzofuran-7-yl)-2-oxidanyl-2-(trifluoromethyl)pentyl]-1,7-naphthyridin-4-one

Systemtic Name: 1-[4-methyl-4-(5-methylsulfonyl-2,3-dihydro-1-benzofuran-7-yl)-2-oxidanyl-2-(trifluoromethyl)pentyl]-1,7-naphthyridin-4-one Openeye Name: 1-[2-hydroxy-4-methyl-4-(5-methylsulfonyl-2,3-dihydrobenzofuran-7-yl)-2-(trifluoromethyl)pentyl]-1,7-naphthyridin-4-one CAS Name: 1-[2-hydroxy-4-methyl-4-(5-methylsulfonyl-2,3-dihydrobenzofuran-7-yl)-2-(trifluoromethyl)pentyl]-1,7-naphthyridin-4-one IUPAC Name: 1-[2-hydroxy-4-methyl-4-(5-methylsulfonyl-2,3-dihydro-1-benzofuran-7-yl)-2-(trifluoromethyl)pentyl]-1,7-naphthyridin-4-one Traditional Name: 1-[2-hydroxy-4-(5-mesylcoumaran-7-yl)-4-methyl-2-(trifluoromethyl)pentyl]-1,7-naphthyridin-4-one Formula: C24H25F3N2O5S MolecularWeight: 510.52591

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(CN1C=CC(=O)C2=C1C=NC=C2)(C(F)(F)F)O)C3=C4C(=CC(=C3)S(=O)(=O)C)CCO4

Isomeric SMILES

CC(C)(CC(CN1C=CC(=O)C2=C1C=NC=C2)(C(F)(F)F)O)C3=C4C(=CC(=C3)S(=O)(=O)C)CCO4

InChI

InChI=1S/C24H25F3N2O5S/c1-22(2,18-11-16(35(3,32)33)10-15-6-9-34-21(15)18)13-23(31,24(25,26)27)14-29-8-5-20(30)17-4-7-28-12-19(17)29/h4-5,7-8,10-12,31H,6,9,13-14H2,1-3H3