Vitas-M small molecule compound
(5Z)-1-(4-methoxyphenyl)-5-{[1-(4-nitrobenzyl)-1H-indol-3-yl]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK085569
SMILES COc1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)Cc2ccc(cc2)[N+](=O)[O-])/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 C27H20N4O6 MW 496.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H20N4O6/c1-37-21-12-10-19(11-13-21)30-26(33)23(25(32)28-27(30)34)14-18-16-29(24-5-3-2-4-22(18)24)15-17-6-8-20(9-7-17)31(35)36/h2-14,16H,15H2,1H3,(H,28,32,34)/b23-14-InChIKey
GTZPBWRGYMWEIK-UCQKPKSFSA-NSynonyms
(5Z)1(4METHOXYPHENYL)5((1((4NITROPHENYL)METHYL)INDOL3YL)METHYLIDENE)13DIAZINANE246TRIONE
(5Z)1(4METHOXYPHENYL)5((1(4NITROBENZYL)1HINDOL3YL)METHYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
COC1=CC=C(C=C1)N2C(=O)C(=CC3=CN(C4=CC=CC=C43)CC5=CC=C(C=C5)(N+)(=O)(O))C(=O)NC2=O
COc1ccc(cc1)N1C(=O)NC(=O)C(=Cc2cn(c3c2cccc3)Cc2ccc(cc2)(N+)(=O)(O))C1=O
InChI=1SC27H20N4O6c13721121019(111321)3026(33)23(25(32)2827(30)34)14181629(24532422(18)24)15176820(9717)31(35)36h21416H15H21H3(H283234)b2314
MFCD03227914
STK085569
ZINC000009680370
ZINC09680370
ZINC9680370
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