Vitas-M small molecule compound
(5E)-1-(4-ethoxyphenyl)-5-(1-{[2-(1H-imidazol-5-yl)ethyl]amino}ethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STL440600
SMILES CCOc1ccc(cc1)N1C(=O)NC(=O)/C(=C(\NCCc2[nH]cnc2)/C)/C1=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 C19H21N5O4 MW 383.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21N5O4/c1-3-28-15-6-4-14(5-7-15)24-18(26)16(17(25)23-19(24)27)12(2)21-9-8-13-10-20-11-22-13/h4-7,10-11,21H,3,8-9H2,1-2H3,(H,20,22)(H,23,25,27)/b16-12+InChIKey
GPSXOEVAZNKRNM-FOWTUZBSSA-NSynonyms
(5E)1(4ethoxyphenyl)5(1((2(1Himidazol5yl)ethyl)amino)ethylidene)pyrimidine246(1H3H5H)trione
(5E)1(4ETHOXYPHENYL)5(1(2(1HIMIDAZOL5YL)ETHYLAMINO)ETHYLIDENE)13DIAZINANE246TRIONE
CCOC1=CC=C(C=C1)N2C(=O)C(=C(C)NCCC3=CN=CN3)C(=O)NC2=O
CCOc1ccc(cc1)N1C(=O)NC(=O)C(=C(NCCc2(nH)cnc2)C)C1=O
InChI=1SC19H21N5O4c1328156414(5715)2418(26)16(17(25)2319(24)27)12(2)2198131020112213h47101121H389H212H3(H2022)(H232527)b1612+
MFCD07773478
ZINC000006907938
ZINC6907938
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