Vitas-M small molecule compound
(5E)-1-(4-bromophenyl)-5-[{[2-(1H-imidazol-5-yl)ethyl]amino}(4-methoxyphenyl)methylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STL440606
SMILES COc1ccc(cc1)/C(=C\1/C(=O)NC(=O)N(C1=O)c1ccc(cc1)Br)/NCCc1[nH]cnc1
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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 C23H20BrN5O4 MW 510.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20BrN5O4/c1-33-18-8-2-14(3-9-18)20(26-11-10-16-12-25-13-27-16)19-21(30)28-23(32)29(22(19)31)17-6-4-15(24)5-7-17/h2-9,12-13,26H,10-11H2,1H3,(H,25,27)(H,28,30,32)/b20-19+InChIKey
UKXMNXRTNZFGAK-FMQUCBEESA-NSynonyms
(5E)1(4bromophenyl)5(((2(1Himidazol5yl)ethyl)amino)(4methoxyphenyl)methylidene)pyrimidine246(1H3H5H)trione
(5E)1(4BROMOPHENYL)5((2(1HIMIDAZOL5YL)ETHYLAMINO)(4METHOXYPHENYL)METHYLIDENE)13DIAZINANE246TRIONE
COC1=CC=C(C=C1)C(=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)Br)NCCC4=CN=CN4
COc1ccc(cc1)C(=C1C(=O)NC(=O)N(C1=O)c1ccc(cc1)Br)NCCc1(nH)cnc1
InChI=1SC23H20BrN5O4c133188214(3918)20(261110161225132716)1921(30)2823(32)29(22(19)31)176415(24)5717h29121326H1011H21H3(H2527)(H283032)b2019+
MFCD07773479
ZINC000025180428
ZINC25180428
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