Vitas-M small molecule compound
(5Z)-1-(4-fluorophenyl)-2,6-dioxo-5-(2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolinium-9-ylmethylidene)-1,2,5,6-tetrahydropyrimidin-4-olate
Catalog ID
STK570844
SMILES Fc1ccc(cc1)N1C(=O)N=C(/C(=C/c2cc3CCC[NH+]4c3c(c2)CCC4)/C1=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 C23H20FN3O3 MW 405.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20FN3O3/c24-17-5-7-18(8-6-17)27-22(29)19(21(28)25-23(27)30)13-14-11-15-3-1-9-26-10-2-4-16(12-14)20(15)26/h5-8,11-13H,1-4,9-10H2,(H,25,28,30)/b19-13-InChIKey
RPCBTSVLJIHSGJ-UYRXBGFRSA-NSynonyms
849916-47-8(5Z)1(4fluorophenyl)26dioxo5(2367tetrahydro1H5Hpyrido(321ij)quinolinium9ylmethylidene)1256tetrahydropyrimidin4olate
849916478
Fc1ccc(cc1)N1C(=O)N=C(C(=Cc2cc3CCC(NH+)4c3c(c2)CCC4)C1=O)(O)
MFCD18245387
ZINC000009350854
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