Vitas-M small molecule compound
(2Z)-3-oxo-2-(pyridin-3-ylmethylidene)-2,3-dihydro-1-benzofuran-6-yl cyclohexanecarboxylate
Catalog ID
STK924190
SMILES O=C(C1CCCCC1)Oc1ccc2c(c1)O/C(=C\c1cccnc1)/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 C21H19NO4 MW 349.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19NO4/c23-20-17-9-8-16(25-21(24)15-6-2-1-3-7-15)12-18(17)26-19(20)11-14-5-4-10-22-13-14/h4-5,8-13,15H,1-3,6-7H2/b19-11-InChIKey
FWFTWLWSOUGFAD-ODLFYWEKSA-NSynonyms
622791-20-2((2Z)3OXO2(PYRIDIN3YLMETHYLIDENE)1BENZOFURAN6YL)CYCLOHEXANECARBOXYLATE
(2Z)3oxo2(pyridin3ylmethylidene)23dihydro1benzofuran6ylcyclohexanecarboxylate
(Z)3oxo2(pyridin3ylmethylene)23dihydrobenzofuran6ylcyclohexanecarboxylate
3OXO2(3PYRIDYLMETHYLENE)BENZO(34B)FURAN6YLCYCLOHEXANECARBOXYLATE
622791202
C1CCC(CC1)C(=O)OC2=CC3=C(C=C2)C(=O)C(=CC4=CN=CC=C4)O3
InChI=1SC21H19NO4c2320179816(2521(24)156213715)1218(17)2619(20)11145410221314h4581315H1367H2b1911
MFCD04154589
O=C(C1CCCCC1)Oc1ccc2c(c1)OC(=Cc1cccnc1)C2=O
ZINC000000533670
ZINC00533670
ZINC533670
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