Vitas-M small molecule compound
(5E)-1-(2,5-diethoxyphenyl)-5-[(1,2,5-trimethyl-1H-pyrrol-3-yl)methylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK127047
SMILES CCOc1ccc(cc1N1C(=O)NC(=O)/C(=C\c2cc(n(c2C)C)C)/C1=O)OCC
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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 C22H25N3O5 MW 411.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N3O5/c1-6-29-16-8-9-19(30-7-2)18(12-16)25-21(27)17(20(26)23-22(25)28)11-15-10-13(3)24(5)14(15)4/h8-12H,6-7H2,1-5H3,(H,23,26,28)/b17-11+InChIKey
XEIKYDDGHHLBTQ-GZTJUZNOSA-NSynonyms
(5E)1(25DIETHOXYPHENYL)5((125TRIMETHYL1HPYRROL3YL)METHYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
(5E)1(25DIETHOXYPHENYL)5((125TRIMETHYLPYRROL3YL)METHYLIDENE)13DIAZINANE246TRIONE
CCOC1=CC(=C(C=C1)OCC)N2C(=O)C(=CC3=C(N(C(=C3)C)C)C)C(=O)NC2=O
CCOc1ccc(cc1N1C(=O)NC(=O)C(=Cc2cc(n(c2C)C)C)C1=O)OCC
InChI=1SC22H25N3O5c1629168919(3072)18(1216)2521(27)17(20(26)2322(25)28)11151013(3)24(5)14(15)4h812H67H215H3(H232628)b1711+
MFCD03063591
ZINC000004700186
ZINC04700186
ZINC4700186
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