Vitas-M small molecule compound
dimethyl 2-{[(2Z)-2-cyano-3-(4-methoxyphenyl)prop-2-enoyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate
Catalog ID
STL331919
SMILES COC(=O)C1CCc2c1c(C(=O)OC)c(s2)NC(=O)/C(=C\c1ccc(cc1)OC)/C#N
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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 C22H20N2O6S MW 440.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N2O6S/c1-28-14-6-4-12(5-7-14)10-13(11-23)19(25)24-20-18(22(27)30-3)17-15(21(26)29-2)8-9-16(17)31-20/h4-7,10,15H,8-9H2,1-3H3,(H,24,25)/b13-10-InChIKey
KNIITMQGDCDMOZ-RAXLEYEMSA-NSynonyms
307539-30-6(Z)dimethyl2(2cyano3(4methoxyphenyl)acrylamido)56dihydro4Hcyclopenta(b)thiophene34dicarboxylate
307539306
COC(=O)C1CCc2c1c(C(=O)OC)c(s2)NC(=O)C(=Cc1ccc(cc1)OC)C#N
COC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=C(C3=C(S2)CCC3C(=O)OC)C(=O)OC
dimethyl2(((2Z)2cyano3(4methoxyphenyl)prop2enoyl)amino)56dihydro4Hcyclopenta(b)thiophene34dicarboxylate
dimethyl2(((Z)2cyano3(4methoxyphenyl)prop2enoyl)amino)56dihydro4Hcyclopenta(b)thiophene34dicarboxylate
InChI=1SC22H20N2O6Sc128146412(5714)1013(1123)19(25)242018(22(27)303)1715(21(26)292)8916(17)3120h471015H89H213H3(H2425)b1310
MFCD03000391
ZINC000000800940
ZINC000000800942
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