Vitas-M small molecule compound
(2Z)-2-(5-bromo-2-methoxybenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl thiophene-2-carboxylate
Catalog ID
STK924123
SMILES COc1ccc(cc1/C=C/1\Oc2c(C1=O)ccc(c2)OC(=O)c1cccs1)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 C21H13BrO5S MW 457.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13BrO5S/c1-25-16-7-4-13(22)9-12(16)10-18-20(23)15-6-5-14(11-17(15)27-18)26-21(24)19-3-2-8-28-19/h2-11H,1H3/b18-10-InChIKey
DNARFDCKVXIKSW-ZDLGFXPLSA-NSynonyms
622362-15-6((2Z)2((5BROMO2METHOXYPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)THIOPHENE2CARBOXYLATE
(2Z)2(5bromo2methoxybenzylidene)3oxo23dihydro1benzofuran6ylthiophene2carboxylate
(Z)2(5bromo2methoxybenzylidene)3oxo23dihydrobenzofuran6ylthiophene2carboxylate
2((5BROMO2METHOXYPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YLTHIOPHENE2CARBOXYLATE
622362156
COC1=C(C=C(C=C1)Br)C=C2C(=O)C3=C(O2)C=C(C=C3)OC(=O)C4=CC=CS4
COc1ccc(cc1C=C1Oc2c(C1=O)ccc(c2)OC(=O)c1cccs1)Br
InChI=1SC21H13BrO5Sc125167413(22)912(16)101820(23)156514(1117(15)2718)2621(24)193282819h211H1H3b1810
MFCD04170382
ZINC000002417963
ZINC02417963
ZINC2417963
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