Vitas-M small molecule compound
(2E)-2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-3-[3-methoxy-4-(2-oxo-2-phenylethoxy)phenyl]prop-2-enenitrile
Catalog ID
STK803678
SMILES N#C/C(=C\c1ccc(c(c1)OC)OCC(=O)c1ccccc1)/c1scc(n1)c1ccc(cc1)Cl
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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 C27H19ClN2O3S MW 486.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H19ClN2O3S/c1-32-26-14-18(7-12-25(26)33-16-24(31)20-5-3-2-4-6-20)13-21(15-29)27-30-23(17-34-27)19-8-10-22(28)11-9-19/h2-14,17H,16H2,1H3/b21-13+InChIKey
XKLBOUXEVLBCNI-FYJGNVAPSA-NSynonyms
333414-51-0(2E)2(4(4chlorophenyl)13thiazol2yl)3(3methoxy4(2oxo2phenylethoxy)phenyl)prop2enenitrile
(E)2(4(4CHLOROPHENYL)13THIAZOL2YL)3(3METHOXY4PHENACYLOXYPHENYL)PROP2ENENITRILE
(E)2(4(4chlorophenyl)thiazol2yl)3(3methoxy4(2oxo2phenylethoxy)phenyl)acrylonitrile
333414510
COC1=C(C=CC(=C1)C=C(C#N)C2=NC(=CS2)C3=CC=C(C=C3)Cl)OCC(=O)C4=CC=CC=C4
InChI=1SC27H19ClN2O3Sc132261418(71225(26)331624(31)205324620)1321(1529)273023(173427)1981022(28)11919h21417H16H21H3b2113+
MFCD03670652
N#CC(=Cc1ccc(c(c1)OC)OCC(=O)c1ccccc1)c1scc(n1)c1ccc(cc1)Cl
ZINC000013658495
ZINC13658495
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