Vitas-M small molecule compound
ethyl 2-({(Z)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl}amino)benzoate
Catalog ID
STK844149
SMILES CCOC(=O)c1ccccc1N/C=C(\c1scc(n1)c1ccc2c(c1)OCO2)/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 C22H17N3O4S MW 419.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17N3O4S/c1-2-27-22(26)16-5-3-4-6-17(16)24-11-15(10-23)21-25-18(12-30-21)14-7-8-19-20(9-14)29-13-28-19/h3-9,11-12,24H,2,13H2,1H3/b15-11-InChIKey
BQCKMQGDMSOFLC-PTNGSMBKSA-NSynonyms
477296-54-1(Z)ethyl2((2(4(benzo(d)(13)dioxol5yl)thiazol2yl)2cyanovinyl)amino)benzoate
477296541
CCOC(=O)C1=CC=CC=C1NC=C(C#N)C2=NC(=CS2)C3=CC4=C(C=C3)OCO4
CCOC(=O)c1ccccc1NC=C(c1scc(n1)c1ccc2c(c1)OCO2)C#N
ethyl2(((Z)2(4(13benzodioxol5yl)13thiazol2yl)2cyanoethenyl)amino)benzoate
ETHYL2((2(4(2HBENZO(34D)13DIOXOLAN5YL)(13THIAZOL2YL))(1Z)2CYANOVINYL)AMINO)BENZOATE
InChI=1SC22H17N3O4Sc122722(26)16534617(16)241115(1023)212518(123021)14781920(914)29132819h39111224H213H21H3b1511
MFCD03670544
ZINC000002202196
ZINC02202196
ZINC2202196
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