Vitas-M small molecule compound
4-ethyl 2-methyl 5-({(Z)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl}amino)-3-methylthiophene-2,4-dicarboxylate
Catalog ID
STK803903
SMILES CCOC(=O)c1c(N/C=C(\c2scc(n2)c2ccc3c(c2)OCO3)/C#N)sc(c1C)C(=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 C23H19N3O6S2 MW 497.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19N3O6S2/c1-4-30-22(27)18-12(2)19(23(28)29-3)34-21(18)25-9-14(8-24)20-26-15(10-33-20)13-5-6-16-17(7-13)32-11-31-16/h5-7,9-10,25H,4,11H2,1-3H3/b14-9-InChIKey
AJTDIAZAASSHFE-ZROIWOOFSA-NSynonyms
573669-44-0(Z)4ethyl2methyl5((2(4(benzo(d)(13)dioxol5yl)thiazol2yl)2cyanovinyl)amino)3methylthiophene24dicarboxylate
4ethyl2methyl5(((Z)2(4(13benzodioxol5yl)13thiazol2yl)2cyanoethenyl)amino)3methylthiophene24dicarboxylate
4Oethyl2Omethyl5(((Z)2(4(13benzodioxol5yl)13thiazol2yl)2cyanoethenyl)amino)3methylthiophene24dicarboxylate
573669440
CCOC(=O)C1=C(SC(=C1C)C(=O)OC)NC=C(C#N)C2=NC(=CS2)C3=CC4=C(C=C3)OCO4
CCOC(=O)c1c(NC=C(c2scc(n2)c2ccc3c(c2)OCO3)C#N)sc(c1C)C(=O)OC
InChI=1SC23H19N3O6S2c143022(27)1812(2)19(23(28)293)3421(18)25914(824)202615(103320)13561617(713)32113116h5791025H411H213H3b149
MFCD04017366
ZINC000009459754
ZINC09459754
ZINC9459754
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