Vitas-M small molecule compound
{(2E)-2-[(2E)-(3-ethoxy-4-{[(4-methoxyphenyl)carbonyl]oxy}benzylidene)hydrazinylidene]-4-oxo-1,3-thiazolidin-5-yl}acetic acid
Catalog ID
STL383687
SMILES CCOc1cc(/C=N/N=C/2\NC(=O)C(S2)CC(=O)O)ccc1OC(=O)c1ccc(cc1)OC
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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 C22H21N3O7S MW 471.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O7S/c1-3-31-17-10-13(12-23-25-22-24-20(28)18(33-22)11-19(26)27)4-9-16(17)32-21(29)14-5-7-15(30-2)8-6-14/h4-10,12,18H,3,11H2,1-2H3,(H,26,27)(H,24,25,28)/b23-12+InChIKey
QPRGVAXITRGLQU-FSJBWODESA-NSynonyms
((2E)2((2E)(3ethoxy4(((4methoxyphenyl)carbonyl)oxy)benzylidene)hydrazinylidene)4oxo13thiazolidin5yl)aceticacid
2(2((2E)2((3ethoxy4(4methoxybenzoyl)oxyphenyl)methylidene)hydrazinyl)4oxo13thiazol5yl)aceticacid
CCOC1=C(C=CC(=C1)C=NNC2=NC(=O)C(S2)CC(=O)O)OC(=O)C3=CC=C(C=C3)OC
CCOc1cc(C=NN=C2NC(=O)C(S2)CC(=O)O)ccc1OC(=O)c1ccc(cc1)OC
InChI=1SC22H21N3O7Sc1331171013(122325222420(28)18(3322)1119(26)27)4916(17)3221(29)145715(302)8614h4101218H311H212H3(H2627)(H242528)b2312+
MFCD03139429
ZINC000016115031
ZINC000016115033
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