Vitas-M small molecule compound

4-({(E)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl}amino)benzamide

Catalog ID
STK839344
SMILES N#C/C(=C\Nc1ccc(cc1)C(=O)N)/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 C20H14N4O3S MW 390.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14N4O3S/c21-8-14(9-23-15-4-1-12(2-5-15)19(22)25)20-24-16(10-28-20)13-3-6-17-18(7-13)27-11-26-17/h1-7,9-10,23H,11H2,(H2,22,25)/b14-9+
InChIKey
IVYPUFCZYHUBJI-NTEUORMPSA-N
Synonyms
383895-97-4
(E)4((2(4(benzo(d)(13)dioxol5yl)thiazol2yl)2cyanovinyl)amino)benzamide
383895974
4(((E)2(4(13benzodioxol5yl)13thiazol2yl)2cyanoethenyl)amino)benzamide
4(2(4BENZO(13)DIOXOL5YLTHIAZOL2YL)2CYANOVINYLAMINO)BENZAMIDE
C1OC2=C(O1)C=C(C=C2)C3=CSC(=N3)C(=CNC4=CC=C(C=C4)C(=O)N)C#N
InChI=1SC20H14N4O3Sc21814(923154112(2515)19(22)25)202416(102820)13361718(713)27112617h1791023H11H2(H22225)b149+
MFCD02232593
N#CC(=CNc1ccc(cc1)C(=O)N)c1scc(n1)c1ccc2c(c1)OCO2
ZINC000000875695
ZINC00875695
ZINC875695

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Available files

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