Vitas-M small molecule compound
(2E)-2-(1,3-benzoxazol-2-yl)-3-(3,4-dimethoxyphenyl)-1-(4-propoxyphenyl)prop-2-en-1-one
Catalog ID
STK896782
SMILES CCCOc1ccc(cc1)C(=O)/C(=C/c1ccc(c(c1)OC)OC)/c1nc2c(o1)cccc2
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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 C27H25NO5 MW 443.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25NO5/c1-4-15-32-20-12-10-19(11-13-20)26(29)21(27-28-22-7-5-6-8-23(22)33-27)16-18-9-14-24(30-2)25(17-18)31-3/h5-14,16-17H,4,15H2,1-3H3/b21-16-InChIKey
QQASDACJHZEFFN-PGMHBOJBSA-NSynonyms
(2E)2(13benzoxazol2yl)3(34dimethoxyphenyl)1(4propoxyphenyl)prop2en1one
(2E)2BENZOXAZOL2YL3(34DIMETHOXYPHENYL)1(4PROPOXYPHENYL)PROP2EN1ONE
(E)2(13BENZOXAZOL2YL)3(34DIMETHOXYPHENYL)1(4PROPOXYPHENYL)PROP2EN1ONE
CCCOC1=CC=C(C=C1)C(=O)C(=CC2=CC(=C(C=C2)OC)OC)C3=NC4=CC=CC=C4O3
CCCOc1ccc(cc1)C(=O)C(=Cc1ccc(c(c1)OC)OC)c1nc2c(o1)cccc2
InChI=1SC27H25NO5c14153220121019(111320)26(29)21(272822756823(22)3327)161891424(302)25(1718)313h5141617H415H213H3b2116
MFCD03029190
ZINC000008763704
ZINC08763704
ZINC8763704
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