Vitas-M small molecule compound
1',3'-dimethyl-8-nitro-4a-(pyridin-3-yl)-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrido[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Catalog ID
STK621678
SMILES O=C1N(C)C(=O)C2(C(=O)N1C)Cc1cc(ccc1N1C2(CCCC1)c1cccnc1)[N+](=O)[O-]
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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 C23H23N5O5 MW 449.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N5O5/c1-25-19(29)22(20(30)26(2)21(25)31)13-15-12-17(28(32)33)7-8-18(15)27-11-4-3-9-23(22,27)16-6-5-10-24-14-16/h5-8,10,12,14H,3-4,9,11,13H2,1-2H3InChIKey
SLBSSYXBDLGXSS-UHFFFAOYSA-NSynonyms
920439-25-413dimethyl8nitro4a(pyridin3yl)12344a6hexahydro1Hspiro(pyrido(12a)quinoline55pyrimidine)246(3H)trione
13dimethyl8nitro4a(pyridin3yl)2344atetrahydro1H2H6Hspiro(pyrido(12a)quinoline55pyrimidine)246(1H3H)trione
13dimethyl8nitro4apyridin3ylspiro(13diazinane552346tetrahydro1Hbenzo(c)quinolizine)246trione
920439254
CN1C(=O)C2(CC3=C(C=CC(=C3)(N+)(=O)(O))N4C2(CCCC4)C5=CN=CC=C5)C(=O)N(C1=O)C
InChI=1SC23H23N5O5c12519(29)22(20(30)26(2)21(25)31)13151217(28(32)33)7818(15)271143923(2227)166510241416h58101214H3491113H212H3
MFCD08744479
O=C1N(C)C(=O)C2(C(=O)N1C)Cc1cc(ccc1N1C2(CCCC1)c1cccnc1)(N+)(=O)(O)
ZINC000009060915
ZINC000009060916
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