Vitas-M small molecule compound
methyl [(5E)-5-(4-butoxy-3-methoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetate
Catalog ID
STL331776
SMILES CCCCOc1ccc(cc1OC)/C=C\1/SC(=S)N(C1=O)CC(=O)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 C18H21NO5S2 MW 395.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21NO5S2/c1-4-5-8-24-13-7-6-12(9-14(13)22-2)10-15-17(21)19(18(25)26-15)11-16(20)23-3/h6-7,9-10H,4-5,8,11H2,1-3H3/b15-10+InChIKey
XUDHEPUARFWSTI-XNTDXEJSSA-NSynonyms
307538-67-6(E)methyl2(5(4butoxy3methoxybenzylidene)4oxo2thioxothiazolidin3yl)acetate
307538676
CCCCOC1=C(C=C(C=C1)C=C2C(=O)N(C(=S)S2)CC(=O)OC)OC
CCCCOc1ccc(cc1OC)C=C1SC(=S)N(C1=O)CC(=O)OC
InChI=1SC18H21NO5S2c145824137612(914(13)222)101517(21)19(18(25)2615)1116(20)233h67910H45811H213H3b1510+
methyl((5E)5(4butoxy3methoxybenzylidene)4oxo2thioxo13thiazolidin3yl)acetate
METHYL2((5E)5((4BUTOXY3METHOXYPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)ACETATE
MFCD03000171
ZINC000001766249
ZINC01766249
ZINC1766249
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