Vitas-M small molecule compound
(2Z)-2-{3-bromo-4-[(4-chlorobenzyl)oxy]benzylidene}-1-benzothiophen-3(2H)-one
Catalog ID
STL376322
SMILES Clc1ccc(cc1)COc1ccc(cc1Br)/C=C/1\Sc2c(C1=O)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 C22H14BrClO2S MW 457.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H14BrClO2S/c23-18-11-15(12-21-22(25)17-3-1-2-4-20(17)27-21)7-10-19(18)26-13-14-5-8-16(24)9-6-14/h1-12H,13H2/b21-12-InChIKey
VVGGPPBEFRCXMO-MTJSOVHGSA-NSynonyms
(2Z)2((3BROMO4((4CHLOROPHENYL)METHOXY)PHENYL)METHYLIDENE)1BENZOTHIOPHEN3ONE
(2Z)2(3bromo4((4chlorobenzyl)oxy)benzylidene)1benzothiophen3(2H)one
C1=CC=C2C(=C1)C(=O)C(=CC3=CC(=C(C=C3)OCC4=CC=C(C=C4)Cl)Br)S2
Clc1ccc(cc1)COc1ccc(cc1Br)C=C1Sc2c(C1=O)cccc2
InChI=1SC22H14BrClO2Sc23181115(122122(25)17312420(17)2721)71019(18)2613145816(24)9614h112H13H2b2112
MFCD04374533
ZINC000009234358
ZINC09234358
ZINC9234358
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