7-[3-(1-azanylcyclopropyl)-4-(trifluoromethyl)pyrrolidin-1-yl]-1-cyclopropyl-6-fluoranyl-8-methoxy-5-oxidanyl-quinazoline-2,4-dione

Systemtic Name: 7-[3-(1-azanylcyclopropyl)-4-(trifluoromethyl)pyrrolidin-1-yl]-1-cyclopropyl-6-fluoranyl-8-methoxy-5-oxidanyl-quinazoline-2,4-dione Openeye Name: 7-[3-(1-aminocyclopropyl)-4-(trifluoromethyl)pyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-5-hydroxy-8-methoxy-quinazoline-2,4-dione CAS Name: 7-[3-(1-aminocyclopropyl)-4-(trifluoromethyl)-1-pyrrolidinyl]-1-cyclopropyl-6-fluoro-5-hydroxy-8-methoxyquinazoline-2,4-dione IUPAC Name: 7-[3-(1-aminocyclopropyl)-4-(trifluoromethyl)pyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-5-hydroxy-8-methoxyquinazoline-2,4-dione Traditional Name: 7-[3-(1-aminocyclopropyl)-4-(trifluoromethyl)pyrrolidino]-1-cyclopropyl-6-fluoro-5-hydroxy-8-methoxy-quinazoline-2,4-quinone Formula: C20H22F4N4O4 MolecularWeight: 458.406693

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C2=C1N(C(=O)NC2=O)C3CC3)O)F)N4CC(C(C4)C(F)(F)F)C5(CC5)N

Isomeric SMILES

COC1=C(C(=C(C2=C1N(C(=O)NC2=O)C3CC3)O)F)N4CC(C(C4)C(F)(F)F)C5(CC5)N

InChI

InChI=1S/C20H22F4N4O4/c1-32-16-13-11(17(30)26-18(31)28(13)8-2-3-8)15(29)12(21)14(16)27-6-9(19(25)4-5-19)10(7-27)20(22,23)24/h8-10,29H,2-7,25H2,1H3,(H,26,30,31)