Vitas-M small molecule compound
methyl (2-{(Z)-[3-(3-nitrobenzyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl}phenoxy)acetate
Catalog ID
STK157146
SMILES COC(=O)COc1ccccc1/C=C/1\SC(=O)N(C1=O)Cc1cccc(c1)[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 C20H16N2O7S MW 428.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N2O7S/c1-28-18(23)12-29-16-8-3-2-6-14(16)10-17-19(24)21(20(25)30-17)11-13-5-4-7-15(9-13)22(26)27/h2-10H,11-12H2,1H3/b17-10-InChIKey
HLYMTRUDLJRPMN-YVLHZVERSA-NSynonyms
COC(=O)COC1=CC=CC=C1C=C2C(=O)N(C(=O)S2)CC3=CC(=CC=C3)(N+)(=O)(O)
COC(=O)COc1ccccc1C=C1SC(=O)N(C1=O)Cc1cccc(c1)(N+)(=O)(O)
InChI=1SC20H16N2O7Sc12818(23)122916832614(16)101719(24)21(20(25)3017)111354715(913)22(26)27h210H1112H21H3b1710
METHYL(2((Z)(3(3NITROBENZYL)24DIOXO13THIAZOLIDIN5YLIDENE)METHYL)PHENOXY)ACETATE
METHYL2(2((3((3NITROPHENYL)METHYL)24DIOXO13THIAZOLIDIN5YLIDENE)METHYL)PHENOXY)ACETATE
METHYL2(2((Z)(3((3NITROPHENYL)METHYL)24DIOXO13THIAZOLIDIN5YLIDENE)METHYL)PHENOXY)ACETATE
MFCD03226805
ZINC000000979788
ZINC00979788
ZINC979788
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