Vitas-M small molecule compound
1'-(2,2-dimethoxyethyl)-3-(4-fluorophenyl)-6-hydroxy-6'-nitro-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-2,4(3H)-dione
Catalog ID
STK591071
SMILES COC(CN1CC2(Cc3c1ccc(c3)[N+](=O)[O-])C(=NC(=O)N(C2=O)c1ccc(cc1)F)O)OC
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C22H21FN4O7 MW 472.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21FN4O7/c1-33-18(34-2)11-25-12-22(10-13-9-16(27(31)32)7-8-17(13)25)19(28)24-21(30)26(20(22)29)15-5-3-14(23)4-6-15/h3-9,18H,10-12H2,1-2H3,(H,24,28,30)InChIKey
IKXBZTIEFJCGNZ-UHFFFAOYSA-NSynonyms
879447-28-61(22dimethoxyethyl)1(4fluorophenyl)6nitrospiro(13diazinane5324dihydroquinoline)246trione
1(22dimethoxyethyl)3(4fluorophenyl)6hydroxy6nitro14dihydro2H2Hspiro(pyrimidine53quinoline)24(3H)dione
879447286
COC(CN1CC2(CC3=C1C=CC(=C3)(N+)(=O)(O))C(=O)NC(=O)N(C2=O)C4=CC=C(C=C4)F)OC
COC(CN1CC2(Cc3c1ccc(c3)(N+)(=O)(O))C(=NC(=O)N(C2=O)c1ccc(cc1)F)O)OC
InChI=1SC22H21FN4O7c13318(342)11251222(1013916(27(31)32)7817(13)25)19(28)2421(30)26(20(22)29)155314(23)4615h3918H1012H212H3(H242830)
MFCD07204634
ZINC000009302894
ZINC000009302895
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