Vitas-M small molecule compound
ethyl 2-({(Z)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl}amino)-4,5-dimethylthiophene-3-carboxylate
Catalog ID
STK803980
SMILES CCOC(=O)c1c(N/C=C(\c2scc(n2)c2ccc3c(c2)OCO3)/C#N)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 C22H19N3O4S2 MW 453.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N3O4S2/c1-4-27-22(26)19-12(2)13(3)31-21(19)24-9-15(8-23)20-25-16(10-30-20)14-5-6-17-18(7-14)29-11-28-17/h5-7,9-10,24H,4,11H2,1-3H3/b15-9-InChIKey
LCLBXFDCWCQUOM-DHDCSXOGSA-NSynonyms
577762-81-3(Z)ethyl2((2(4(benzo(d)(13)dioxol5yl)thiazol2yl)2cyanovinyl)amino)45dimethylthiophene3carboxylate
577762813
CCOC(=O)C1=C(SC(=C1C)C)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
ethyl2(((Z)2(4(13benzodioxol5yl)13thiazol2yl)2cyanoethenyl)amino)45dimethylthiophene3carboxylate
InChI=1SC22H19N3O4S2c142722(26)1912(2)13(3)3121(19)24915(823)202516(103020)14561718(714)29112817h5791024H411H213H3b159
MFCD04018627
ZINC000010232886
ZINC10232886
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