N-[(2R,3R,4R)-2-(dimethoxymethyl)-2-methyl-3-oxidanyl-4-(2-sulfanylidene-1,3-benzoxazol-3-yl)-3,4-dihydrochromen-6-yl]-2,2,2-tris(fluoranyl)ethanamide

Systemtic Name: N-[(2R,3R,4R)-2-(dimethoxymethyl)-2-methyl-3-oxidanyl-4-(2-sulfanylidene-1,3-benzoxazol-3-yl)-3,4-dihydrochromen-6-yl]-2,2,2-tris(fluoranyl)ethanamide Openeye Name: N-[(2R,3R,4R)-2-(dimethoxymethyl)-3-hydroxy-2-methyl-4-(2-thioxo-1,3-benzoxazol-3-yl)chroman-6-yl]-2,2,2-trifluoro-acetamide CAS Name: N-[(2R,3R,4R)-2-(dimethoxymethyl)-3-hydroxy-2-methyl-4-(2-sulfanylidene-1,3-benzoxazol-3-yl)-3,4-dihydro-2H-1-benzopyran-6-yl]-2,2,2-trifluoroacetamide IUPAC Name: N-[(2R,3R,4R)-2-(dimethoxymethyl)-3-hydroxy-2-methyl-4-(2-sulfanylidene-1,3-benzoxazol-3-yl)-3,4-dihydrochromen-6-yl]-2,2,2-trifluoroacetamide Traditional Name: N-[(2R,3R,4R)-2-(dimethoxymethyl)-3-hydroxy-2-methyl-4-(2-thioxo-1,3-benzoxazol-3-yl)chroman-6-yl]-2,2,2-trifluoro-acetamide Formula: C22H21F3N2O6S MolecularWeight: 498.47215

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)NC(=O)C(F)(F)F)N3C4=CC=CC=C4OC3=S)O)C(OC)OC

Isomeric SMILES

C[C@@]1([C@@H]([C@@H](C2=C(O1)C=CC(=C2)NC(=O)C(F)(F)F)N3C4=CC=CC=C4OC3=S)O)C(OC)OC

InChI

InChI=1S/C22H21F3N2O6S/c1-21(19(30-2)31-3)17(28)16(27-13-6-4-5-7-15(13)32-20(27)34)12-10-11(8-9-14(12)33-21)26-18(29)22(23,24)25/h4-10,16-17,19,28H,1-3H3,(H,26,29)/t16-,17-,21-/m1/s1