1-[(2S,4S,5R)-5-(3,3-dimethyl-1-oxidanyl-2-oxidanylidene-butyl)-2,3,3-tris(fluoranyl)-4-[(1-methyl-4H-pyridin-3-yl)carbonyl]-4-oxidanyl-oxolan-2-yl]-5-methyl-pyrimidine-2,4-dione

Systemtic Name: 1-[(2S,4S,5R)-5-(3,3-dimethyl-1-oxidanyl-2-oxidanylidene-butyl)-2,3,3-tris(fluoranyl)-4-[(1-methyl-4H-pyridin-3-yl)carbonyl]-4-oxidanyl-oxolan-2-yl]-5-methyl-pyrimidine-2,4-dione Openeye Name: 5-methyl-1-[(2S,4S,5R)-2,3,3-trifluoro-4-hydroxy-5-(1-hydroxy-3,3-dimethyl-2-oxo-butyl)-4-(1-methyl-4H-pyridine-3-carbonyl)tetrahydrofuran-2-yl]pyrimidine-2,4-dione CAS Name: 5-methyl-1-[(2S,4S,5R)-2,3,3-trifluoro-4-hydroxy-5-(1-hydroxy-3,3-dimethyl-2-oxobutyl)-4-[(1-methyl-4H-pyridin-3-yl)-oxomethyl]-2-oxolanyl]pyrimidine-2,4-dione IUPAC Name: 5-methyl-1-[(2S,4S,5R)-2,3,3-trifluoro-4-hydroxy-5-(1-hydroxy-3,3-dimethyl-2-oxobutyl)-4-(1-methyl-4H-pyridine-3-carbonyl)oxolan-2-yl]pyrimidine-2,4-dione Traditional Name: 5-methyl-1-[(2S,4S,5R)-2,3,3-trifluoro-4-hydroxy-5-(1-hydroxy-2-keto-3,3-dimethyl-butyl)-4-(1-methyl-4H-pyridine-3-carbonyl)tetrahydrofuran-2-yl]pyrimidine-2,4-quinone Formula: C22H26F3N3O7 MolecularWeight: 501.45295

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)NC1=O)C2(C(C(C(O2)C(C(=O)C(C)(C)C)O)(C(=O)C3=CN(C=CC3)C)O)(F)F)F

Isomeric SMILES

CC1=CN(C(=O)NC1=O)[C@]2(C([C@]([C@H](O2)C(C(=O)C(C)(C)C)O)(C(=O)C3=CN(C=CC3)C)O)(F)F)F

InChI

InChI=1S/C22H26F3N3O7/c1-11-9-28(18(33)26-17(11)32)22(25)21(23,24)20(34,14(30)12-7-6-8-27(5)10-12)16(35-22)13(29)15(31)19(2,3)4/h6,8-10,13,16,29,34H,7H2,1-5H3,(H,26,32,33)/t13?,16-,20-,22+/m1/s1