Vitas-M small molecule compound
(2E)-2-(4-ethoxy-3-methoxybenzylidene)-1-benzothiophen-3(2H)-one
Catalog ID
STK325124
SMILES CCOc1ccc(cc1OC)/C=C\1/Sc2c(C1=O)cccc2
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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 C18H16O3S MW 312.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16O3S/c1-3-21-14-9-8-12(10-15(14)20-2)11-17-18(19)13-6-4-5-7-16(13)22-17/h4-11H,3H2,1-2H3/b17-11+InChIKey
HDXGFKNZRHVTQR-GZTJUZNOSA-NSynonyms
(2E)2((4ETHOXY3METHOXYPHENYL)METHYLIDENE)1BENZOTHIOPHEN3ONE
(2E)2(4ETHOXY3METHOXYBENZYLIDENE)1BENZOTHIOPHEN3(2H)ONE
CCOC1=C(C=C(C=C1)C=C2C(=O)C3=CC=CC=C3S2)OC
CCOc1ccc(cc1OC)C=C1Sc2c(C1=O)cccc2
InChI=1SC18H16O3Sc1321149812(1015(14)202)111718(19)13645716(13)2217h411H3H212H3b1711+
MFCD01246005
ZINC000000063801
ZINC00063801
ZINC63801
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