Vitas-M small molecule compound
(5Z)-5-[4-(benzyloxy)-3-methoxybenzylidene]-3-(1,1-dioxidotetrahydrothiophen-3-yl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK823547
SMILES COc1cc(ccc1OCc1ccccc1)/C=C/1\SC(=S)N(C1=O)C1CCS(=O)(=O)C1
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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 C22H21NO5S3 MW 475.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21NO5S3/c1-27-19-11-16(7-8-18(19)28-13-15-5-3-2-4-6-15)12-20-21(24)23(22(29)30-20)17-9-10-31(25,26)14-17/h2-8,11-12,17H,9-10,13-14H2,1H3/b20-12-InChIKey
RVXVTFZGWSCFLZ-NDENLUEZSA-NSynonyms
(5Z)3(11DIOXOTHIOLAN3YL)5((3METHOXY4PHENYLMETHOXYPHENYL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)5(4(benzyloxy)3methoxybenzylidene)3(11dioxidotetrahydrothiophen3yl)2thioxo13thiazolidin4one
(Z)5(4(benzyloxy)3methoxybenzylidene)3(11dioxidotetrahydrothiophen3yl)2thioxothiazolidin4one
COC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)S2)C3CCS(=O)(=O)C3)OCC4=CC=CC=C4
COc1cc(ccc1OCc1ccccc1)C=C1SC(=S)N(C1=O)C1CCS(=O)(=O)C1
InChI=1SC22H21NO5S3c127191116(7818(19)2813155324615)122021(24)23(22(29)3020)1791031(2526)1417h28111217H9101314H21H3b2012
MFCD02987601
ZINC000013426877
ZINC000013426879
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