Vitas-M small molecule compound
(2E)-3-[3-methoxy-4-(2-oxo-2-phenylethoxy)phenyl]-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Catalog ID
STK803737
SMILES N#C/C(=C\c1ccc(c(c1)OC)OCC(=O)c1ccccc1)/c1scc(n1)c1ccc(cc1)[N+](=O)[O-]
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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 C27H19N3O5S MW 497.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H19N3O5S/c1-34-26-14-18(7-12-25(26)35-16-24(31)20-5-3-2-4-6-20)13-21(15-28)27-29-23(17-36-27)19-8-10-22(11-9-19)30(32)33/h2-14,17H,16H2,1H3/b21-13+InChIKey
WIBKNFNZTPKQPV-FYJGNVAPSA-NSynonyms
333414-57-6(2E)3(3methoxy4(2oxo2phenylethoxy)phenyl)2(4(4nitrophenyl)13thiazol2yl)prop2enenitrile
(E)3(3methoxy4(2oxo2phenylethoxy)phenyl)2(4(4nitrophenyl)thiazol2yl)acrylonitrile
(E)3(3METHOXY4PHENACYLOXYPHENYL)2(4(4NITROPHENYL)13THIAZOL2YL)PROP2ENENITRILE
333414576
COC1=C(C=CC(=C1)C=C(C#N)C2=NC(=CS2)C3=CC=C(C=C3)(N+)(=O)(O))OCC(=O)C4=CC=CC=C4
InChI=1SC27H19N3O5Sc134261418(71225(26)351624(31)205324620)1321(1528)272923(173627)1981022(11919)30(32)33h21417H16H21H3b2113+
MFCD03672081
N#CC(=Cc1ccc(c(c1)OC)OCC(=O)c1ccccc1)c1scc(n1)c1ccc(cc1)(N+)(=O)(O)
ZINC000013659214
ZINC13659214
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