Vitas-M small molecule compound
(8E)-7-[(2E)-3-chlorobut-2-en-1-yl]-8-{(2E)-[1-(4-methoxyphenyl)ethylidene]hydrazinylidene}-1,3-dimethyl-3,7,8,9-tetrahydro-1H-purine-2,6-dione
Catalog ID
STK569646
SMILES COc1ccc(cc1)/C(=N/N=c/1\[nH]c2c(n1C/C=C(/Cl)\C)c(=O)n(c(=O)n2C)C)/C
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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 C20H23ClN6O3 MW 430.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23ClN6O3/c1-12(21)10-11-27-16-17(25(3)20(29)26(4)18(16)28)22-19(27)24-23-13(2)14-6-8-15(30-5)9-7-14/h6-10H,11H2,1-5H3,(H,22,24)/b12-10+,23-13+InChIKey
BIIXGMLDTPXDBP-JKQBSQSDSA-NSynonyms
478253-46-2(8E)7((2E)3chlorobut2en1yl)8((2E)(1(4methoxyphenyl)ethylidene)hydrazinylidene)13dimethyl3789tetrahydro1Hpurine26dione
478253462
COc1ccc(cc1)C(=NN=c1(nH)c2c(n1CC=C(Cl)C)c(=O)n(c(=O)n2C)C)C
MFCD05736146
ZINC000005909210
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