Vitas-M small molecule compound
(2E)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-3-[(2,4,6-trimethylphenyl)amino]prop-2-enenitrile
Catalog ID
STK549168
SMILES N#C/C(=C\Nc1c(C)cc(cc1C)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 C22H19N3O2S MW 389.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N3O2S/c1-13-6-14(2)21(15(3)7-13)24-10-17(9-23)22-25-18(11-28-22)16-4-5-19-20(8-16)27-12-26-19/h4-8,10-11,24H,12H2,1-3H3/b17-10+InChIKey
HYMZXPPANCJBDS-LICLKQGHSA-NSynonyms
477292-72-1(2E)2(4(13benzodioxol5yl)13thiazol2yl)3((246trimethylphenyl)amino)prop2enenitrile
(E)2(4(13BENZODIOXOL5YL)13THIAZOL2YL)3(246TRIMETHYLANILINO)PROP2ENENITRILE
(E)2(4(benzo(d)(13)dioxol5yl)thiazol2yl)3(mesitylamino)acrylonitrile
477292721
CC1=CC(=C(C(=C1)C)NC=C(C#N)C2=NC(=CS2)C3=CC4=C(C=C3)OCO4)C
InChI=1SC22H19N3O2Sc113614(2)21(15(3)713)241017(923)222518(112822)16451920(816)27122619h48101124H12H213H3b1710+
MFCD01956626
N#CC(=CNc1c(C)cc(cc1C)C)c1scc(n1)c1ccc2c(c1)OCO2
ZINC000005024876
ZINC05024876
ZINC5024876
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