Vitas-M small molecule compound
(5Z)-5-[(2E)-3-(1-benzyl-1H-indol-3-yl)-1-hydroxyprop-2-en-1-ylidene]-6-hydroxy-3-methylpyrimidine-2,4(3H,5H)-dione
Catalog ID
STK607219
SMILES O=C1N=C(O)/C(=C(\C=C\c2cn(c3c2cccc3)Cc2ccccc2)/O)/C(=O)N1C
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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 C23H19N3O4 MW 401.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19N3O4/c1-25-22(29)20(21(28)24-23(25)30)19(27)12-11-16-14-26(13-15-7-3-2-4-8-15)18-10-6-5-9-17(16)18/h2-12,14,27H,13H2,1H3,(H,24,28,30)/b12-11+,20-19-InChIKey
QVRMHVHZCLXRQY-SEKJBOIESA-NSynonyms
(5Z)5((2E)3(1benzyl1Hindol3yl)1hydroxyprop2en1ylidene)6hydroxy3methylpyrimidine24(3H5H)dione
(5Z)5((E)3(1benzylindol3yl)1hydroxyprop2enylidene)1methyl13diazinane246trione
CN1C(=O)C(=C(C=CC2=CN(C3=CC=CC=C32)CC4=CC=CC=C4)O)C(=O)NC1=O
InChI=1SC23H19N3O4c12522(29)20(21(28)2423(25)30)19(27)1211161426(13157324815)181065917(16)18h2121427H13H21H3(H242830)b1211+2019
MFCD08733269
O=C1N=C(O)C(=C(C=Cc2cn(c3c2cccc3)Cc2ccccc2)O)C(=O)N1C
ZINC000101403789
ZINC101403789
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