Vitas-M small molecule compound
{(5E)-5-[4-(2,4-dinitrophenoxy)-3-methoxybenzylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}acetic acid
Catalog ID
STK392718
SMILES COc1cc(ccc1Oc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])/C=C\1/SC(=S)N(C1=O)CC(=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 C19H13N3O9S2 MW 491.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H13N3O9S2/c1-30-15-6-10(7-16-18(25)20(9-17(23)24)19(32)33-16)2-4-14(15)31-13-5-3-11(21(26)27)8-12(13)22(28)29/h2-8H,9H2,1H3,(H,23,24)/b16-7+InChIKey
UWBNVQQVMRYCQP-FRKPEAEDSA-NSynonyms
((5E)5(4(24dinitrophenoxy)3methoxybenzylidene)4oxo2thioxo13thiazolidin3yl)aceticacid
2((5E)5((4(24DINITROPHENOXY)3METHOXYPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)ACETICACID
2(5((4(24DINITROPHENOXY)3METHOXYPHENYL)METHYLENE)4OXO2THIOXO13THIAZOLIDIN3YL)ACETICACID
COC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)S2)CC(=O)O)OC3=C(C=C(C=C3)(N+)(=O)(O))(N+)(=O)(O)
COc1cc(ccc1Oc1ccc(cc1(N+)(=O)(O))(N+)(=O)(O))C=C1SC(=S)N(C1=O)CC(=O)O
InChI=1SC19H13N3O9S2c13015610(71618(25)20(917(23)24)19(32)3316)2414(15)31135311(21(26)27)812(13)22(28)29h28H9H21H3(H2324)b167+
MFCD01008631
ZINC000003765901
ZINC3765901
Check stock
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