Vitas-M small molecule compound
(2Z)-2-[(3-methylthiophen-2-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl cyclohexanecarboxylate
Catalog ID
STK924189
SMILES O=C(C1CCCCC1)Oc1ccc2c(c1)O/C(=C\c1sccc1C)/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 C21H20O4S MW 368.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20O4S/c1-13-9-10-26-19(13)12-18-20(22)16-8-7-15(11-17(16)25-18)24-21(23)14-5-3-2-4-6-14/h7-12,14H,2-6H2,1H3/b18-12-InChIKey
MDXSGDQMLLJEQY-PDGQHHTCSA-NSynonyms
622791-88-2((2Z)2((3METHYLTHIOPHEN2YL)METHYLIDENE)3OXO1BENZOFURAN6YL)CYCLOHEXANECARBOXYLATE
(2Z)2((3methylthiophen2yl)methylidene)3oxo23dihydro1benzofuran6ylcyclohexanecarboxylate
(Z)2((3methylthiophen2yl)methylene)3oxo23dihydrobenzofuran6ylcyclohexanecarboxylate
2((3METHYL(2THIENYL))METHYLENE)3OXOBENZO(34B)FURAN6YLCYCLOHEXANECARBOXYLATE
622791882
CC1=C(SC=C1)C=C2C(=O)C3=C(O2)C=C(C=C3)OC(=O)C4CCCCC4
InChI=1SC21H20O4Sc1139102619(13)121820(22)168715(1117(16)2518)2421(23)145324614h71214H26H21H3b1812
MFCD04182974
O=C(C1CCCCC1)Oc1ccc2c(c1)OC(=Cc1sccc1C)C2=O
ZINC000002368092
ZINC02368092
ZINC2368092
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