Vitas-M small molecule compound
(5Z)-3-benzyl-5-{3-methoxy-4-[(3-nitrobenzyl)oxy]benzylidene}-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STL380305
SMILES COc1cc(ccc1OCc1cccc(c1)[N+](=O)[O-])/C=C/1\SC(=S)N(C1=O)Cc1ccccc1
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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 C25H20N2O5S2 MW 492.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20N2O5S2/c1-31-22-13-18(10-11-21(22)32-16-19-8-5-9-20(12-19)27(29)30)14-23-24(28)26(25(33)34-23)15-17-6-3-2-4-7-17/h2-14H,15-16H2,1H3/b23-14-InChIKey
JQMUSYJHZWRCIS-UCQKPKSFSA-NSynonyms
(5Z)3benzyl5((3methoxy4((3nitrophenyl)methoxy)phenyl)methylidene)2sulfanylidene13thiazolidin4one
(5Z)3benzyl5(3methoxy4((3nitrobenzyl)oxy)benzylidene)2thioxo13thiazolidin4one
COC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)S2)CC3=CC=CC=C3)OCC4=CC(=CC=C4)(N+)(=O)(O)
COc1cc(ccc1OCc1cccc(c1)(N+)(=O)(O))C=C1SC(=S)N(C1=O)Cc1ccccc1
InChI=1SC25H20N2O5S2c131221318(101121(22)32161985920(1219)27(29)30)142324(28)26(25(33)3423)15176324717h214H1516H21H3b2314
MFCD28951205
ZINC000098087024
ZINC98087024
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