Vitas-M small molecule compound
(2E)-2-(1,3-benzoxazol-2-yl)-1-(3,4-dimethoxyphenyl)-3-(thiophen-2-yl)prop-2-en-1-one
Catalog ID
STL008879
SMILES COc1cc(ccc1OC)C(=O)/C(=C/c1cccs1)/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 C22H17NO4S MW 391.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17NO4S/c1-25-19-10-9-14(12-20(19)26-2)21(24)16(13-15-6-5-11-28-15)22-23-17-7-3-4-8-18(17)27-22/h3-13H,1-2H3/b16-13-InChIKey
LOPBANIOEZXPKB-SSZFMOIBSA-NSynonyms
929866-21-7(2E)2(13benzoxazol2yl)1(34dimethoxyphenyl)3(thiophen2yl)prop2en1one
(E)2(13benzoxazol2yl)1(34dimethoxyphenyl)3thiophen2ylprop2en1one
(E)2(benzo(d)oxazol2yl)1(34dimethoxyphenyl)3(thiophen2yl)prop2en1one
929866217
COC1=C(C=C(C=C1)C(=O)C(=CC2=CC=CS2)C3=NC4=CC=CC=C4O3)OC
COc1cc(ccc1OC)C(=O)C(=Cc1cccs1)c1nc2c(o1)cccc2
InChI=1SC22H17NO4Sc1251910914(1220(19)262)21(24)16(131565112815)222317734818(17)2722h313H12H3b1613
MFCD09844777
ZINC000009482908
ZINC09482908
ZINC9482908
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