Vitas-M small molecule compound
(2Z)-2-{2-bromo-4-[(4-chlorobenzyl)oxy]-5-methoxybenzylidene}-1-benzothiophen-3(2H)-one
Catalog ID
STK387779
SMILES COc1cc(/C=C/2\Sc3c(C2=O)cccc3)c(cc1OCc1ccc(cc1)Cl)Br
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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 C23H16BrClO3S MW 487.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16BrClO3S/c1-27-19-10-15(11-22-23(26)17-4-2-3-5-21(17)29-22)18(24)12-20(19)28-13-14-6-8-16(25)9-7-14/h2-12H,13H2,1H3/b22-11-InChIKey
GHSTVRZPCDPRMF-JJFYIABZSA-NSynonyms
(2Z)2((2BROMO4((4CHLOROPHENYL)METHOXY)5METHOXYPHENYL)METHYLIDENE)1BENZOTHIOPHEN3ONE
(2Z)2(2BROMO4((4CHLOROBENZYL)OXY)5METHOXYBENZYLIDENE)1BENZOTHIOPHEN3(2H)ONE
(Z)2(2bromo4((4chlorobenzyl)oxy)5methoxybenzylidene)benzo(b)thiophen3(2H)one
2((2BROMO4((4CHLOROPHENYL)METHOXY)5METHOXYPHENYL)METHYLENE)BENZO(B)THIOPHEN3ONE
COC1=C(C=C(C(=C1)C=C2C(=O)C3=CC=CC=C3S2)Br)OCC4=CC=C(C=C4)Cl
COc1cc(C=C2Sc3c(C2=O)cccc3)c(cc1OCc1ccc(cc1)Cl)Br
InChI=1SC23H16BrClO3Sc127191015(112223(26)17423521(17)2922)18(24)1220(19)2813146816(25)9714h212H13H21H3b2211
MFCD01824689
ZINC000002251638
ZINC02251638
ZINC2251638
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