Vitas-M small molecule compound
[(5E)-5-{[3-(4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetic acid
Catalog ID
STK732957
SMILES COc1ccc(cc1)c1nn(cc1/C=C\1/SC(=S)N(C1=O)CC(=O)O)c1ccccc1
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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 C22H17N3O4S2 MW 451.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17N3O4S2/c1-29-17-9-7-14(8-10-17)20-15(12-25(23-20)16-5-3-2-4-6-16)11-18-21(28)24(13-19(26)27)22(30)31-18/h2-12H,13H2,1H3,(H,26,27)/b18-11+InChIKey
LXEJBEOUHDTOJY-WOJGMQOQSA-NSynonyms
956043-18-8((5E)5((3(4methoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)4oxo2thioxo13thiazolidin3yl)aceticacid
(E)2(5((3(4methoxyphenyl)1phenyl1Hpyrazol4yl)methylene)4oxo2thioxothiazolidin3yl)aceticacid
2((5E)5((3(4METHOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)ACETICACID
2(5((3(4METHOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLENE)4OXO2THIOXO13THIAZOLIDIN3YL)ACETICACID
956043188
COC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CC(=O)O)C4=CC=CC=C4
COc1ccc(cc1)c1nn(cc1C=C1SC(=S)N(C1=O)CC(=O)O)c1ccccc1
InChI=1SC22H17N3O4S2c129179714(81017)2015(1225(2320)165324616)111821(28)24(1319(26)27)22(30)3118h212H13H21H3(H2627)b1811+
MFCD04194041
ZINC000002430219
ZINC2430219
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