Vitas-M small molecule compound
(2E)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-3-[(4-methylphenyl)amino]prop-2-enenitrile
Catalog ID
STL327456
SMILES N#C/C(=C\Nc1ccc(cc1)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 C20H15N3O2S MW 361.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15N3O2S/c1-13-2-5-16(6-3-13)22-10-15(9-21)20-23-17(11-26-20)14-4-7-18-19(8-14)25-12-24-18/h2-8,10-11,22H,12H2,1H3/b15-10+InChIKey
APKKQWPGJAMYMZ-XNTDXEJSSA-NSynonyms
373373-36-5(2E)2(4(13benzodioxol5yl)13thiazol2yl)3((4methylphenyl)amino)prop2enenitrile
(E)2(4(13BENZODIOXOL5YL)13THIAZOL2YL)3(4METHYLANILINO)PROP2ENENITRILE
(E)2(4(benzo(d)(13)dioxol5yl)thiazol2yl)3(ptolylamino)acrylonitrile
373373365
CC1=CC=C(C=C1)NC=C(C#N)C2=NC(=CS2)C3=CC4=C(C=C3)OCO4
InChI=1SC20H15N3O2Sc1132516(6313)221015(921)202317(112620)14471819(814)25122418h28101122H12H21H3b1510+
MFCD01946214
N#CC(=CNc1ccc(cc1)C)c1scc(n1)c1ccc2c(c1)OCO2
ZINC000004805284
ZINC4805284
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