Vitas-M small molecule compound

(2Z)-3-oxo-2-[(2E)-3-phenylprop-2-en-1-ylidene]-2,3-dihydro-1-benzofuran-6-yl methanesulfonate

Catalog ID
STK852396
SMILES O=C1/C(=C/C=C/c2ccccc2)/Oc2c1ccc(c2)OS(=O)(=O)C

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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 C18H14O5S MW 342.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14O5S/c1-24(20,21)23-14-10-11-15-17(12-14)22-16(18(15)19)9-5-8-13-6-3-2-4-7-13/h2-12H,1H3/b8-5+,16-9-
InChIKey
LLKOIOPUDUDOFR-FJGPGAONSA-N
Synonyms
620545-79-1
((2Z)3OXIDANYLIDENE2((E)3PHENYLPROP2ENYLIDENE)1BENZOFURAN6YL)METHANESULFONATE
((2Z)3OXO2((E)3PHENYLPROP2ENYLIDENE)1BENZOFURAN6YL)METHANESULFONATE
(2Z)3oxo2((2E)3phenylprop2en1ylidene)23dihydro1benzofuran6ylmethanesulfonate
(Z)3oxo2((E)3phenylallylidene)23dihydrobenzofuran6ylmethanesulfonate
2((2E)3PHENYLPROP2ENYLIDENE)3OXOBENZO(34B)FURAN6YLMETHYLSULFONATE
620545791
CS(=O)(=O)OC1=CC2=C(C=C1)C(=O)C(=CC=CC3=CC=CC=C3)O2
InChI=1SC18H14O5Sc124(2021)231410111517(1214)2216(18(15)19)958136324713h212H1H3b85+169
METHANESULFONICACID((2Z)3KETO2((E)3PHENYLPROP2ENYLIDENE)COUMARAN6YL)ESTER
METHANESULFONICACID((2Z)3OXO2((E)3PHENYLPROP2ENYLIDENE)6BENZOFURANYL)ESTER
METHANESULFONICACID3OXO2((E)3PHENYLPROP2EN(Z)YLIDENE)23DIHYDROBENZOFURAN6YLESTER
MFCD04171156
O=C1C(=CC=Cc2ccccc2)Oc2c1ccc(c2)OS(=O)(=O)C
ZINC000013477976
ZINC13477976

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Available files

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