Vitas-M small molecule compound
butyl 4-{[(E)-2-cyano-2-(4-cyclopropyl-1,3-thiazol-2-yl)ethenyl]amino}benzoate
Catalog ID
STK878558
SMILES CCCCOC(=O)c1ccc(cc1)N/C=C(/c1scc(n1)C1CC1)\C#N
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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 C20H21N3O2S MW 367.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O2S/c1-2-3-10-25-20(24)15-6-8-17(9-7-15)22-12-16(11-21)19-23-18(13-26-19)14-4-5-14/h6-9,12-14,22H,2-5,10H2,1H3/b16-12+InChIKey
QJBDASFRZAIIJU-FOWTUZBSSA-NSynonyms
1021231-31-11021231311
butyl4(((E)2cyano2(4cyclopropyl13thiazol2yl)ethenyl)amino)benzoate
CCCCOC(=O)C1=CC=C(C=C1)NC=C(C#N)C2=NC(=CS2)C3CC3
CCCCOC(=O)c1ccc(cc1)NC=C(c1scc(n1)C1CC1)C#N
InChI=1SC20H21N3O2Sc123102520(24)156817(9715)221216(1121)192318(132619)144514h69121422H2510H21H3b1612+
MFCD11992907
ZINC000017270513
ZINC17270513
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