Vitas-M small molecule compound
(5Z)-5-[3-methoxy-4-(naphthalen-1-ylmethoxy)benzylidene]-3-(4-nitrobenzyl)-1,3-thiazolidine-2,4-dione
Catalog ID
STL297187
SMILES COc1cc(ccc1OCc1cccc2c1cccc2)/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 C29H22N2O6S MW 526.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H22N2O6S/c1-36-26-15-20(11-14-25(26)37-18-22-7-4-6-21-5-2-3-8-24(21)22)16-27-28(32)30(29(33)38-27)17-19-9-12-23(13-10-19)31(34)35/h2-16H,17-18H2,1H3/b27-16-InChIKey
AHOTUZZKDGZELW-YUMHPJSZSA-NSynonyms
(5Z)5((3METHOXY4(NAPHTHALEN1YLMETHOXY)PHENYL)METHYLIDENE)3((4NITROPHENYL)METHYL)13THIAZOLIDINE24DIONE
(5Z)5(3methoxy4(naphthalen1ylmethoxy)benzylidene)3(4nitrobenzyl)13thiazolidine24dione
COC1=C(C=CC(=C1)C=C2C(=O)N(C(=O)S2)CC3=CC=C(C=C3)(N+)(=O)(O))OCC4=CC=CC5=CC=CC=C54
COc1cc(ccc1OCc1cccc2c1cccc2)C=C1SC(=O)N(C1=O)Cc1ccc(cc1)(N+)(=O)(O)
InChI=1SC29H22N2O6Sc136261520(111425(26)37182274621523824(21)22)162728(32)30(29(33)3827)171991223(131019)31(34)35h216H1718H21H3b2716
MFCD04087083
ZINC000100338309
ZINC100338309
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