Vitas-M small molecule compound
(2Z)-3-oxo-2-(pyridin-4-ylmethylidene)-2,3-dihydro-1-benzofuran-6-yl 5-ethoxy-2-phenyl-1-benzofuran-3-carboxylate
Catalog ID
STK924223
SMILES CCOc1ccc2c(c1)c(C(=O)Oc1ccc3c(c1)O/C(=C\c1ccncc1)/C3=O)c(o2)c1ccccc1
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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 C31H21NO6 MW 503.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H21NO6/c1-2-35-21-9-11-25-24(17-21)28(30(38-25)20-6-4-3-5-7-20)31(34)36-22-8-10-23-26(18-22)37-27(29(23)33)16-19-12-14-32-15-13-19/h3-18H,2H2,1H3/b27-16-InChIKey
ZHTALUQDOCRXES-YUMHPJSZSA-NSynonyms
622809-68-1((2Z)3OXO2(PYRIDIN4YLMETHYLIDENE)1BENZOFURAN6YL)5ETHOXY2PHENYL1BENZOFURAN3CARBOXYLATE
(2Z)3oxo2(pyridin4ylmethylidene)23dihydro1benzofuran6yl5ethoxy2phenyl1benzofuran3carboxylate
(Z)3oxo2(pyridin4ylmethylene)23dihydrobenzofuran6yl5ethoxy2phenylbenzofuran3carboxylate
3OXO2(4PYRIDYLMETHYLENE)BENZO(34B)FURAN6YL5ETHOXY2PHENYLBENZO(B)FURAN3CARBOXYLATE
622809681
CCOC1=CC2=C(C=C1)OC(=C2C(=O)OC3=CC4=C(C=C3)C(=O)C(=CC5=CC=NC=C5)O4)C6=CC=CC=C6
CCOc1ccc2c(c1)c(C(=O)Oc1ccc3c(c1)OC(=Cc1ccncc1)C3=O)c(o2)c1ccccc1
InChI=1SC31H21NO6c1235219112524(1721)28(30(3825)206435720)31(34)36228102326(1822)3727(29(23)33)1619121432151319h318H2H21H3b2716
MFCD04169252
ZINC000009282598
ZINC09282598
ZINC9282598
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