Vitas-M small molecule compound
(2Z)-2-[(3-methylthiophen-2-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl 4-chlorobenzenesulfonate
Catalog ID
STK857192
SMILES Clc1ccc(cc1)S(=O)(=O)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 C20H13ClO5S2 MW 432.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13ClO5S2/c1-12-8-9-27-19(12)11-18-20(22)16-7-4-14(10-17(16)25-18)26-28(23,24)15-5-2-13(21)3-6-15/h2-11H,1H3/b18-11-InChIKey
JRINUCJPJLYVPP-WQRHYEAKSA-NSynonyms
929472-63-9((2Z)2((3methylthiophen2yl)methylidene)3oxo1benzofuran6yl)4chlorobenzenesulfonate
(2Z)2((3methylthiophen2yl)methylidene)3oxo23dihydro1benzofuran6yl4chlorobenzenesulfonate
(Z)2((3methylthiophen2yl)methylene)3oxo23dihydrobenzofuran6yl4chlorobenzenesulfonate
2((3METHYL(2THIENYL))METHYLENE)3OXOBENZO(34B)FURAN6YL4CHLOROBENZENESULFONATE
929472639
CC1=C(SC=C1)C=C2C(=O)C3=C(O2)C=C(C=C3)OS(=O)(=O)C4=CC=C(C=C4)Cl
Clc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)OC(=Cc1sccc1C)C2=O
InChI=1SC20H13ClO5S2c112892719(12)111820(22)167414(1017(16)2518)2628(2324)155213(21)3615h211H1H3b1811
MFCD09795105
ZINC000008990379
ZINC08990379
ZINC8990379
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