Vitas-M small molecule compound
(2Z)-2-(1,3-benzoxazol-2-yl)-1-(4-butoxyphenyl)-3-(3,4-dimethoxyphenyl)prop-2-en-1-one
Catalog ID
STK793933
SMILES CCCCOc1ccc(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 C28H27NO5 MW 457.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27NO5/c1-4-5-16-33-21-13-11-20(12-14-21)27(30)22(28-29-23-8-6-7-9-24(23)34-28)17-19-10-15-25(31-2)26(18-19)32-3/h6-15,17-18H,4-5,16H2,1-3H3/b22-17+InChIKey
XCXGTGQQFNAAGO-OQKWZONESA-NSynonyms
494200-47-4(2Z)2(13benzoxazol2yl)1(4butoxyphenyl)3(34dimethoxyphenyl)prop2en1one
(2Z)2BENZOXAZOL2YL3(34DIMETHOXYPHENYL)1(4BUTOXYPHENYL)PROP2EN1ONE
(Z)2(13benzoxazol2yl)1(4butoxyphenyl)3(34dimethoxyphenyl)prop2en1one
(Z)2(benzo(d)oxazol2yl)1(4butoxyphenyl)3(34dimethoxyphenyl)prop2en1one
494200474
CCCCOC1=CC=C(C=C1)C(=O)C(=CC2=CC(=C(C=C2)OC)OC)C3=NC4=CC=CC=C4O3
CCCCOc1ccc(cc1)C(=O)C(=Cc1ccc(c(c1)OC)OC)c1nc2c(o1)cccc2
InChI=1SC28H27NO5c145163321131120(121421)27(30)22(282923867924(23)3428)1719101525(312)26(1819)323h6151718H4516H213H3b2217+
MFCD03301990
ZINC000008915582
ZINC08915582
ZINC8915582
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