Vitas-M small molecule compound

(2Z)-2-[4-(benzyloxy)-2-bromo-5-methoxybenzylidene]-1-benzothiophen-3(2H)-one

Catalog ID
STK377671
SMILES COc1cc(/C=C/2\Sc3c(C2=O)cccc3)c(cc1OCc1ccccc1)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 C23H17BrO3S MW 453.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17BrO3S/c1-26-19-11-16(12-22-23(25)17-9-5-6-10-21(17)28-22)18(24)13-20(19)27-14-15-7-3-2-4-8-15/h2-13H,14H2,1H3/b22-12-
InChIKey
IHSCSODIUGWXHA-UUYOSTAYSA-N
Synonyms

(2Z)2((2BROMO5METHOXY4PHENYLMETHOXYPHENYL)METHYLIDENE)1BENZOTHIOPHEN3ONE
(2Z)2(4(benzyloxy)2bromo5methoxybenzylidene)1benzothiophen3(2H)one
(Z)2(4(benzyloxy)2bromo5methoxybenzylidene)benzo(b)thiophen3(2H)one
2((2BROMO5METHOXY4(PHENYLMETHOXY)PHENYL)METHYLENE)BENZO(B)THIOPHEN3ONE
COC1=C(C=C(C(=C1)C=C2C(=O)C3=CC=CC=C3S2)Br)OCC4=CC=CC=C4
COc1cc(C=C2Sc3c(C2=O)cccc3)c(cc1OCc1ccccc1)Br
InChI=1SC23H17BrO3Sc126191116(122223(25)179561021(17)2822)18(24)1320(19)2714157324815h213H14H21H3b2212
MFCD01824767
ZINC000002285423
ZINC02285423
ZINC2285423

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Available files

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