Vitas-M small molecule compound
(5Z)-5-{3-ethoxy-4-[(2-nitrobenzyl)oxy]benzylidene}-3-(4-nitrobenzyl)-1,3-thiazolidine-2,4-dione
Catalog ID
STL358185
SMILES CCOc1cc(ccc1OCc1ccccc1[N+](=O)[O-])/C=C/1\SC(=O)N(C1=O)Cc1ccc(cc1)[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 C26H21N3O8S MW 535.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21N3O8S/c1-2-36-23-13-18(9-12-22(23)37-16-19-5-3-4-6-21(19)29(34)35)14-24-25(30)27(26(31)38-24)15-17-7-10-20(11-8-17)28(32)33/h3-14H,2,15-16H2,1H3/b24-14-InChIKey
BOMXPKOKTRHYEB-OYKKKHCWSA-NSynonyms
(5Z)5((3ETHOXY4((2NITROPHENYL)METHOXY)PHENYL)METHYLIDENE)3((4NITROPHENYL)METHYL)13THIAZOLIDINE24DIONE
(5Z)5(3ethoxy4((2nitrobenzyl)oxy)benzylidene)3(4nitrobenzyl)13thiazolidine24dione
CCOC1=C(C=CC(=C1)C=C2C(=O)N(C(=O)S2)CC3=CC=C(C=C3)(N+)(=O)(O))OCC4=CC=CC=C4(N+)(=O)(O)
CCOc1cc(ccc1OCc1ccccc1(N+)(=O)(O))C=C1SC(=O)N(C1=O)Cc1ccc(cc1)(N+)(=O)(O)
InChI=1SC26H21N3O8Sc1236231318(91222(23)371619534621(19)29(34)35)142425(30)27(26(31)3824)151771020(11817)28(32)33h314H21516H21H3b2414
MFCD07085031
ZINC000101341722
ZINC101341722
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