Vitas-M small molecule compound
butyl 4-{[(E)-2-cyano-2-(4-phenyl-1,3-thiazol-2-yl)ethenyl]amino}benzoate
Catalog ID
STK878552
SMILES CCCCOC(=O)c1ccc(cc1)N/C=C(/c1scc(n1)c1ccccc1)\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 C23H21N3O2S MW 403.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N3O2S/c1-2-3-13-28-23(27)18-9-11-20(12-10-18)25-15-19(14-24)22-26-21(16-29-22)17-7-5-4-6-8-17/h4-12,15-16,25H,2-3,13H2,1H3/b19-15+InChIKey
YQVODZCGCZVHTG-XDJHFCHBSA-NSynonyms
1021251-42-21021251422
butyl4(((E)2cyano2(4phenyl13thiazol2yl)ethenyl)amino)benzoate
CCCCOC(=O)C1=CC=C(C=C1)NC=C(C#N)C2=NC(=CS2)C3=CC=CC=C3
CCCCOC(=O)c1ccc(cc1)NC=C(c1scc(n1)c1ccccc1)C#N
InChI=1SC23H21N3O2Sc123132823(27)1891120(121018)251519(1424)222621(162922)177546817h412151625H2313H21H3b1915+
MFCD11992902
ZINC000017270533
ZINC17270533
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