Vitas-M small molecule compound
(2Z)-2-[(3-methylthiophen-2-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl benzoate
Catalog ID
STK924209
SMILES O=C1/C(=C/c2sccc2C)/Oc2c1ccc(c2)OC(=O)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 C21H14O4S MW 362.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14O4S/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/h2-12H,1H3/b18-12-InChIKey
KGBZLZVVHCYEAN-PDGQHHTCSA-NSynonyms
622362-03-2((2Z)2((3METHYLTHIOPHEN2YL)METHYLIDENE)3OXO1BENZOFURAN6YL)BENZOATE
(2Z)2((3methylthiophen2yl)methylidene)3oxo23dihydro1benzofuran6ylbenzoate
(Z)2((3methylthiophen2yl)methylene)3oxo23dihydrobenzofuran6ylbenzoate
2((3METHYL(2THIENYL))METHYLENE)3OXOBENZO(34B)FURAN6YLBENZOATE
622362032
CC1=C(SC=C1)C=C2C(=O)C3=C(O2)C=C(C=C3)OC(=O)C4=CC=CC=C4
InChI=1SC21H14O4Sc1139102619(13)121820(22)168715(1117(16)2518)2421(23)145324614h212H1H3b1812
MFCD04163978
O=C1C(=Cc2sccc2C)Oc2c1ccc(c2)OC(=O)c1ccccc1
ZINC000013768406
ZINC13768406
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