Vitas-M small molecule compound
(2Z)-2-[(5-methylfuran-2-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl 4-chlorobenzenesulfonate
Catalog ID
STK856424
SMILES Clc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)O/C(=C\c1ccc(o1)C)/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 C20H13ClO6S MW 416.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13ClO6S/c1-12-2-5-14(25-12)10-19-20(22)17-9-6-15(11-18(17)26-19)27-28(23,24)16-7-3-13(21)4-8-16/h2-11H,1H3/b19-10-InChIKey
SZPADAXISWPNHS-GRSHGNNSSA-NSynonyms
929472-25-3((2Z)2((5methylfuran2yl)methylidene)3oxo1benzofuran6yl)4chlorobenzenesulfonate
(2Z)2((5methylfuran2yl)methylidene)3oxo23dihydro1benzofuran6yl4chlorobenzenesulfonate
(Z)2((5methylfuran2yl)methylene)3oxo23dihydrobenzofuran6yl4chlorobenzenesulfonate
2((5METHYL(2FURYL))METHYLENE)3OXOBENZO(34B)FURAN6YL4CHLOROBENZENESULFONATE
929472253
CC1=CC=C(O1)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(=Cc1ccc(o1)C)C2=O
InChI=1SC20H13ClO6Sc1122514(2512)101920(22)179615(1118(17)2619)2728(2324)167313(21)4816h211H1H3b1910
MFCD09798194
ZINC000008990900
ZINC08990900
ZINC8990900
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