Vitas-M small molecule compound
(2Z)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-3-[(2,6-dimethylphenyl)amino]prop-2-enenitrile
Catalog ID
STK551023
SMILES N#C/C(=C/Nc1c(C)cccc1C)/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 C21H17N3O2S MW 375.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17N3O2S/c1-13-4-3-5-14(2)20(13)23-10-16(9-22)21-24-17(11-27-21)15-6-7-18-19(8-15)26-12-25-18/h3-8,10-11,23H,12H2,1-2H3/b16-10-InChIKey
JCQWGUMDIJWOHC-YBEGLDIGSA-NSynonyms
683257-08-1(2Z)2(4(13benzodioxol5yl)13thiazol2yl)3((26dimethylphenyl)amino)prop2enenitrile
(Z)2(4(13BENZODIOXOL5YL)13THIAZOL2YL)3(26DIMETHYLANILINO)PROP2ENENITRILE
(Z)2(4(benzo(d)(13)dioxol5yl)thiazol2yl)3((26dimethylphenyl)amino)acrylonitrile
683257081
CC1=C(C(=CC=C1)C)NC=C(C#N)C2=NC(=CS2)C3=CC4=C(C=C3)OCO4
InChI=1SC21H17N3O2Sc11343514(2)20(13)231016(922)212417(112721)15671819(815)26122518h38101123H12H212H3b1610
MFCD03672138
N#CC(=CNc1c(C)cccc1C)c1scc(n1)c1ccc2c(c1)OCO2
ZINC000002205254
ZINC02205254
ZINC2205254
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