Vitas-M small molecule compound
(2Z)-2-{2-bromo-5-methoxy-4-[(4-methylbenzyl)oxy]benzylidene}-1-benzothiophen-3(2H)-one
Catalog ID
STK377669
SMILES COc1cc(/C=C/2\Sc3c(C2=O)cccc3)c(cc1OCc1ccc(cc1)C)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 C24H19BrO3S MW 467.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19BrO3S/c1-15-7-9-16(10-8-15)14-28-21-13-19(25)17(11-20(21)27-2)12-23-24(26)18-5-3-4-6-22(18)29-23/h3-13H,14H2,1-2H3/b23-12-InChIKey
SAAFTKILLVGELC-FMCGGJTJSA-NSynonyms
(2Z)2((2BROMO5METHOXY4((4METHYLPHENYL)METHOXY)PHENYL)METHYLIDENE)1BENZOTHIOPHEN3ONE
(2Z)2(2bromo5methoxy4((4methylbenzyl)oxy)benzylidene)1benzothiophen3(2H)one
(Z)2(2bromo5methoxy4((4methylbenzyl)oxy)benzylidene)benzo(b)thiophen3(2H)one
2((2BROMO5METHOXY4((4METHYLPHENYL)METHOXY)PHENYL)METHYLENE)BENZO(B)THIOPHEN3ONE
CC1=CC=C(C=C1)COC2=C(C=C(C(=C2)Br)C=C3C(=O)C4=CC=CC=C4S3)OC
COc1cc(C=C2Sc3c(C2=O)cccc3)c(cc1OCc1ccc(cc1)C)Br
InChI=1SC24H19BrO3Sc1157916(10815)1428211319(25)17(1120(21)272)122324(26)18534622(18)2923h313H14H212H3b2312
MFCD01824742
ZINC000013800142
ZINC13800142
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