Vitas-M small molecule compound
(2Z)-2-(4-tert-butylbenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl 4-chlorobenzenesulfonate
Catalog ID
STK992387
SMILES Clc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)O/C(=C\c1ccc(cc1)C(C)(C)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 C25H21ClO5S MW 468.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21ClO5S/c1-25(2,3)17-6-4-16(5-7-17)14-23-24(27)21-13-10-19(15-22(21)30-23)31-32(28,29)20-11-8-18(26)9-12-20/h4-15H,1-3H3/b23-14-InChIKey
TUGKDDKUDKYYOD-UCQKPKSFSA-NSynonyms
929472-21-9((2Z)2((4tertbutylphenyl)methylidene)3oxo1benzofuran6yl)4chlorobenzenesulfonate
(2Z)2(4tertbutylbenzylidene)3oxo23dihydro1benzofuran6yl4chlorobenzenesulfonate
(Z)2(4(tertbutyl)benzylidene)3oxo23dihydrobenzofuran6yl4chlorobenzenesulfonate
2((4(TERTBUTYL)PHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YL4CHLOROBENZENESULFONATE
929472219
CC(C)(C)C1=CC=C(C=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(=Cc1ccc(cc1)C(C)(C)C)C2=O
InChI=1SC25H21ClO5Sc125(23)176416(5717)142324(27)21131019(1522(21)3023)3132(2829)2011818(26)91220h415H13H3b2314
MFCD09849105
ZINC000009051448
ZINC09051448
ZINC9051448
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