Vitas-M small molecule compound
methyl (2-iodo-6-methoxy-4-{(Z)-[3-(2-nitrobenzyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl}phenoxy)acetate
Catalog ID
STL378997
SMILES COC(=O)COc1c(I)cc(cc1OC)/C=C/1\SC(=O)N(C1=O)Cc1ccccc1[N+](=O)[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 C21H17IN2O8S MW 584.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17IN2O8S/c1-30-16-8-12(7-14(22)19(16)32-11-18(25)31-2)9-17-20(26)23(21(27)33-17)10-13-5-3-4-6-15(13)24(28)29/h3-9H,10-11H2,1-2H3/b17-9-InChIKey
LEKVERNIQVEHHE-MFOYZWKCSA-NSynonyms
COC(=O)COc1c(I)cc(cc1OC)C=C1SC(=O)N(C1=O)Cc1ccccc1(N+)(=O)(O)
COC1=C(C(=CC(=C1)C=C2C(=O)N(C(=O)S2)CC3=CC=CC=C3(N+)(=O)(O))I)OCC(=O)OC
InChI=1SC21H17IN2O8Sc13016812(714(22)19(16)321118(25)312)91720(26)23(21(27)3317)1013534615(13)24(28)29h39H1011H212H3b179
methyl(2iodo6methoxy4((Z)(3(2nitrobenzyl)24dioxo13thiazolidin5ylidene)methyl)phenoxy)acetate
METHYL2(2IODO6METHOXY4((Z)(3((2NITROPHENYL)METHYL)24DIOXO13THIAZOLIDIN5YLIDENE)METHYL)PHENOXY)ACETATE
MFCD07084730
ZINC000105979372
ZINC105979372
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