Vitas-M small molecule compound
dimethyl 5-({(Z)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl}amino)-3-methylthiophene-2,4-dicarboxylate
Catalog ID
STK576029
SMILES N#C/C(=C/Nc1sc(c(c1C(=O)OC)C)C(=O)OC)/c1scc(n1)c1ccc2c(c1)OCO2
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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 C22H17N3O6S2 MW 483.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17N3O6S2/c1-11-17(21(26)28-2)20(33-18(11)22(27)29-3)24-8-13(7-23)19-25-14(9-32-19)12-4-5-15-16(6-12)31-10-30-15/h4-6,8-9,24H,10H2,1-3H3/b13-8-InChIKey
KXRCVNLHASMQKT-JYRVWZFOSA-NSynonyms
896803-08-0(Z)dimethyl5((2(4(benzo(d)(13)dioxol5yl)thiazol2yl)2cyanovinyl)amino)3methylthiophene24dicarboxylate
896803080
CC1=C(SC(=C1C(=O)OC)NC=C(C#N)C2=NC(=CS2)C3=CC4=C(C=C3)OCO4)C(=O)OC
dimethyl5(((Z)2(4(13benzodioxol5yl)13thiazol2yl)2cyanoethenyl)amino)3methylthiophene24dicarboxylate
InChI=1SC22H17N3O6S2c11117(21(26)282)20(3318(11)22(27)293)24813(723)192514(93219)12451516(612)31103015h468924H10H213H3b138
MFCD06593268
N#CC(=CNc1sc(c(c1C(=O)OC)C)C(=O)OC)c1scc(n1)c1ccc2c(c1)OCO2
ZINC000002441978
ZINC02441978
ZINC2441978
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