Vitas-M small molecule compound
3-{(5Z)-5-[4-(benzyloxy)-3-methoxybenzylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}propanoic acid
Catalog ID
STK235777
SMILES COc1cc(ccc1OCc1ccccc1)/C=C/1\SC(=S)N(C1=O)CCC(=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 C21H19NO5S2 MW 429.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19NO5S2/c1-26-17-11-15(7-8-16(17)27-13-14-5-3-2-4-6-14)12-18-20(25)22(21(28)29-18)10-9-19(23)24/h2-8,11-12H,9-10,13H2,1H3,(H,23,24)/b18-12-InChIKey
ZPPKKFFFNYMUPD-PDGQHHTCSA-NSynonyms
302949-54-83((5Z)5((3methoxy4phenylmethoxyphenyl)methylidene)4oxo2sulfanylidene13thiazolidin3yl)propanoicacid
3((5Z)5(4(benzyloxy)3methoxybenzylidene)4oxo2thioxo13thiazolidin3yl)propanoicacid
3(5((3METHOXY4(PHENYLMETHOXY)PHENYL)METHYLENE)4OXO2THIOXO13THIAZOLIDIN3YL)PROPANOICACID
302949548
COC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)S2)CCC(=O)O)OCC3=CC=CC=C3
COc1cc(ccc1OCc1ccccc1)C=C1SC(=S)N(C1=O)CCC(=O)O
InChI=1SC21H19NO5S2c126171115(7816(17)2713145324614)121820(25)22(21(28)2918)10919(23)24h281112H91013H21H3(H2324)b1812
MFCD02165874
ZINC000000967015
ZINC967015
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