Vitas-M small molecule compound
methyl (2Z)-2-[4-(methylsulfanyl)benzylidene]-3-oxo-2,3-dihydro-1-benzofuran-5-carboxylate
Catalog ID
STK818890
SMILES CSc1ccc(cc1)/C=C/1\Oc2c(C1=O)cc(cc2)C(=O)OC
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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 C18H14O4S MW 326.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14O4S/c1-21-18(20)12-5-8-15-14(10-12)17(19)16(22-15)9-11-3-6-13(23-2)7-4-11/h3-10H,1-2H3/b16-9-InChIKey
NIVHOSFUYMCIJE-SXGWCWSVSA-NSynonyms
868143-33-3868143333
COC(=O)C1=CC2=C(C=C1)OC(=CC3=CC=C(C=C3)SC)C2=O
CSc1ccc(cc1)C=C1Oc2c(C1=O)cc(cc2)C(=O)OC
InChI=1SC18H14O4Sc12118(20)12581514(1012)17(19)16(2215)9113613(232)7411h310H12H3b169
METHYL(2Z)2((4METHYLSULFANYLPHENYL)METHYLIDENE)3OXO1BENZOFURAN5CARBOXYLATE
methyl(2Z)2(4(methylsulfanyl)benzylidene)3oxo23dihydro1benzofuran5carboxylate
METHYL2((4METHYLTHIOPHENYL)METHYLENE)3OXOBENZO(B)FURAN5CARBOXYLATE
MFCD04448102
ZINC000000429872
ZINC00429872
ZINC429872
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