Vitas-M small molecule compound

(2E)-7-methyl-2-[(1-methyl-1H-indol-3-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl acetate

Catalog ID
STK627521
SMILES CC(=O)Oc1ccc2c(c1C)O/C(=C/c1cn(c3c1cccc3)C)/C2=O

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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 C21H17NO4 MW 347.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17NO4/c1-12-18(25-13(2)23)9-8-16-20(24)19(26-21(12)16)10-14-11-22(3)17-7-5-4-6-15(14)17/h4-11H,1-3H3/b19-10+
InChIKey
YTEGPRSNCKJQQO-VXLYETTFSA-N
Synonyms
929379-47-5
((2E)7methyl2((1methylindol3yl)methylidene)3oxo1benzofuran6yl)acetate
(2E)7methyl2((1methyl1Hindol3yl)methylidene)3oxo23dihydro1benzofuran6ylacetate
(E)7methyl2((1methyl1Hindol3yl)methylene)3oxo23dihydrobenzofuran6ylacetate
7METHYL2((1METHYLINDOL3YL)METHYLENE)3OXOBENZO(34B)FURAN6YLACETATE
929379475
CC(=O)Oc1ccc2c(c1C)OC(=Cc1cn(c3c1cccc3)C)C2=O
CC1=C(C=CC2=C1OC(=CC3=CN(C4=CC=CC=C43)C)C2=O)OC(=O)C
InChI=1SC21H17NO4c11218(2513(2)23)981620(24)19(2621(12)16)10141122(3)17754615(14)17h411H13H3b1910+
MFCD09797160
ZINC000009423257
ZINC09423257
ZINC9423257

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Available files

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