Vitas-M small molecule compound
ethyl 4,5-dimethyl-2-({4-[(5E)-4-oxo-5-(thiophen-2-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl]butanoyl}amino)thiophene-3-carboxylate
Catalog ID
STL036074
SMILES CCOC(=O)c1c(NC(=O)CCCN2C(=S)S/C(=C/c3cccs3)/C2=O)sc(c1C)C
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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 C21H22N2O4S4 MW 494.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O4S4/c1-4-27-20(26)17-12(2)13(3)30-18(17)22-16(24)8-5-9-23-19(25)15(31-21(23)28)11-14-7-6-10-29-14/h6-7,10-11H,4-5,8-9H2,1-3H3,(H,22,24)/b15-11+InChIKey
GVWABGDVUABKIH-RVDMUPIBSA-NSynonyms
900134-49-8900134498
CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CCCN2C(=O)C(=CC3=CC=CS3)SC2=S
CCOC(=O)c1c(NC(=O)CCCN2C(=S)SC(=Cc3cccs3)C2=O)sc(c1C)C
ethyl45dimethyl2((4((5E)4oxo5(thiophen2ylmethylidene)2thioxo13thiazolidin3yl)butanoyl)amino)thiophene3carboxylate
ethyl45dimethyl2(4((5E)4oxo2sulfanylidene5(thiophen2ylmethylidene)13thiazolidin3yl)butanoylamino)thiophene3carboxylate
InChI=1SC21H22N2O4S4c142720(26)1712(2)13(3)3018(17)2216(24)8592319(25)15(3121(23)28)111476102914h671011H4589H213H3(H2224)b1511+
MFCD07808267
ZINC000010232785
ZINC10232785
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