Vitas-M small molecule compound
(2Z)-3-oxo-2-(pyridin-3-ylmethylidene)-2,3-dihydro-1-benzofuran-6-yl 2-bromobenzoate
Catalog ID
STK924262
SMILES O=C1/C(=C/c2cccnc2)/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/c22-17-6-2-1-5-15(17)21(25)26-14-7-8-16-18(11-14)27-19(20(16)24)10-13-4-3-9-23-12-13/h1-12H/b19-10-InChIKey
RKLYNIZDUYWEOJ-GRSHGNNSSA-NSynonyms
622366-74-9((2Z)3OXO2(PYRIDIN3YLMETHYLIDENE)1BENZOFURAN6YL)2BROMOBENZOATE
(2Z)3oxo2(pyridin3ylmethylidene)23dihydro1benzofuran6yl2bromobenzoate
(Z)3oxo2(pyridin3ylmethylene)23dihydrobenzofuran6yl2bromobenzoate
3OXO2(3PYRIDYLMETHYLENE)BENZO(34B)FURAN6YL2BROMOBENZOATE
622366749
C1=CC=C(C(=C1)C(=O)OC2=CC3=C(C=C2)C(=O)C(=CC4=CN=CC=C4)O3)Br
InChI=1SC21H12BrNO4c2217621515(17)21(25)2614781618(1114)2719(20(16)24)1013439231213h112Hb1910
MFCD04184680
O=C1C(=Cc2cccnc2)Oc2c1ccc(c2)OC(=O)c1ccccc1Br
ZINC000009161210
ZINC09161210
ZINC9161210
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