Vitas-M small molecule compound
methyl 2-({(Z)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl}amino)-4,5-dimethylthiophene-3-carboxylate
Catalog ID
STK585685
SMILES N#C/C(=C/Nc1sc(c(c1C(=O)OC)C)C)/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 C21H17N3O4S2 MW 439.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17N3O4S2/c1-11-12(2)30-20(18(11)21(25)26-3)23-8-14(7-22)19-24-15(9-29-19)13-4-5-16-17(6-13)28-10-27-16/h4-6,8-9,23H,10H2,1-3H3/b14-8-InChIKey
JROLANPZIVWJHM-ZSOIEALJSA-NSynonyms
896806-21-6(Z)methyl2((2(4(benzo(d)(13)dioxol5yl)thiazol2yl)2cyanovinyl)amino)45dimethylthiophene3carboxylate
896806216
CC1=C(SC(=C1C(=O)OC)NC=C(C#N)C2=NC(=CS2)C3=CC4=C(C=C3)OCO4)C
InChI=1SC21H17N3O4S2c11112(2)3020(18(11)21(25)263)23814(722)192415(92919)13451617(613)28102716h468923H10H213H3b148
methyl2(((Z)2(4(13benzodioxol5yl)13thiazol2yl)2cyanoethenyl)amino)45dimethylthiophene3carboxylate
MFCD06595205
N#CC(=CNc1sc(c(c1C(=O)OC)C)C)c1scc(n1)c1ccc2c(c1)OCO2
ZINC000002198325
ZINC02198325
ZINC2198325
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