Vitas-M small molecule compound
(2Z)-3-oxo-2-(pyridin-4-ylmethylidene)-2,3-dihydro-1-benzofuran-6-yl 2-bromobenzoate
Catalog ID
STK924248
SMILES O=C1/C(=C/c2ccncc2)/Oc2c1ccc(c2)OC(=O)c1ccccc1Br
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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 C21H12BrNO4 MW 422.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H12BrNO4/c22-17-4-2-1-3-15(17)21(25)26-14-5-6-16-18(12-14)27-19(20(16)24)11-13-7-9-23-10-8-13/h1-12H/b19-11-InChIKey
LNZTYYIIMUGYRU-ODLFYWEKSA-NSynonyms
622366-84-1((2Z)3OXO2(PYRIDIN4YLMETHYLIDENE)1BENZOFURAN6YL)2BROMOBENZOATE
(2Z)3oxo2(pyridin4ylmethylidene)23dihydro1benzofuran6yl2bromobenzoate
(Z)3oxo2(pyridin4ylmethylene)23dihydrobenzofuran6yl2bromobenzoate
3OXO2(4PYRIDYLMETHYLENE)BENZO(34B)FURAN6YL2BROMOBENZOATE
622366841
C1=CC=C(C(=C1)C(=O)OC2=CC3=C(C=C2)C(=O)C(=CC4=CC=NC=C4)O3)Br
InChI=1SC21H12BrNO4c2217421315(17)21(25)2614561618(1214)2719(20(16)24)1113792310813h112Hb1911
MFCD04187620
O=C1C(=Cc2ccncc2)Oc2c1ccc(c2)OC(=O)c1ccccc1Br
ZINC000009161368
ZINC09161368
ZINC9161368
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