Vitas-M small molecule compound
(5Z)-5-{2-[3-(4-chlorophenoxy)propoxy]-5-nitrobenzylidene}-3-phenyl-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK036455
SMILES Clc1ccc(cc1)OCCCOc1ccc(cc1/C=C/1\SC(=S)N(C1=O)c1ccccc1)[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 C25H19ClN2O5S2 MW 527.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19ClN2O5S2/c26-18-7-10-21(11-8-18)32-13-4-14-33-22-12-9-20(28(30)31)15-17(22)16-23-24(29)27(25(34)35-23)19-5-2-1-3-6-19/h1-3,5-12,15-16H,4,13-14H2/b23-16-InChIKey
PKQJVEBIKYVGML-KQWNVCNZSA-NSynonyms
(5Z)5((2(3(4CHLOROPHENOXY)PROPOXY)5NITROPHENYL)METHYLIDENE)3PHENYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)5(2(3(4CHLOROPHENOXY)PROPOXY)5NITROBENZYLIDENE)3PHENYL2THIOXO13THIAZOLIDIN4ONE
C1=CC=C(C=C1)N2C(=O)C(=CC3=C(C=CC(=C3)(N+)(=O)(O))OCCCOC4=CC=C(C=C4)Cl)SC2=S
Clc1ccc(cc1)OCCCOc1ccc(cc1C=C1SC(=S)N(C1=O)c1ccccc1)(N+)(=O)(O)
InChI=1SC25H19ClN2O5S2c261871021(11818)3213414332212920(28(30)31)1517(22)162324(29)27(25(34)3523)195213619h135121516H41314H2b2316
MFCD05977268
STK036455
ZINC000101421919
ZINC101421919
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