Vitas-M small molecule compound
(5E)-1-(4-bromophenyl)-5-[{[2-(1H-imidazol-5-yl)ethyl]amino}(phenyl)methylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STL440603
SMILES Brc1ccc(cc1)N1C(=O)NC(=O)/C(=C(/c2ccccc2)\NCCc2[nH]cnc2)/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 C22H18BrN5O3 MW 480.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18BrN5O3/c23-15-6-8-17(9-7-15)28-21(30)18(20(29)27-22(28)31)19(14-4-2-1-3-5-14)25-11-10-16-12-24-13-26-16/h1-9,12-13,25H,10-11H2,(H,24,26)(H,27,29,31)/b19-18+InChIKey
MRSSGGMCEOJTGV-VHEBQXMUSA-NSynonyms
(5E)1(4bromophenyl)5(((2(1Himidazol5yl)ethyl)amino)(phenyl)methylidene)pyrimidine246(1H3H5H)trione
(5E)1(4BROMOPHENYL)5((2(1HIMIDAZOL5YL)ETHYLAMINO)PHENYLMETHYLIDENE)13DIAZINANE246TRIONE
Brc1ccc(cc1)N1C(=O)NC(=O)C(=C(c2ccccc2)NCCc2(nH)cnc2)C1=O
C1=CC=C(C=C1)C(=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)Br)NCCC4=CN=CN4
InChI=1SC22H18BrN5O3c23156817(9715)2821(30)18(20(29)2722(28)31)19(144213514)251110161224132616h19121325H1011H2(H2426)(H272931)b1918+
MFCD07756088
ZINC000025180411
ZINC25180411
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