Vitas-M small molecule compound

(2Z)-2-[(3-methylthiophen-2-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl 2-chlorobenzoate

Catalog ID
STK924328
SMILES O=C1/C(=C/c2sccc2C)/Oc2c1ccc(c2)OC(=O)c1ccccc1Cl

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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 C21H13ClO4S MW 396.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13ClO4S/c1-12-8-9-27-19(12)11-18-20(23)15-7-6-13(10-17(15)26-18)25-21(24)14-4-2-3-5-16(14)22/h2-11H,1H3/b18-11-
InChIKey
AJAUNWQFMXIPSA-WQRHYEAKSA-N
Synonyms
622789-91-7
((2Z)2((3METHYLTHIOPHEN2YL)METHYLIDENE)3OXO1BENZOFURAN6YL)2CHLOROBENZOATE
(2Z)2((3methylthiophen2yl)methylidene)3oxo23dihydro1benzofuran6yl2chlorobenzoate
(Z)2((3methylthiophen2yl)methylene)3oxo23dihydrobenzofuran6yl2chlorobenzoate
2((3METHYL(2THIENYL))METHYLENE)3OXOBENZO(34B)FURAN6YL2CHLOROBENZOATE
622789917
CC1=C(SC=C1)C=C2C(=O)C3=C(O2)C=C(C=C3)OC(=O)C4=CC=CC=C4Cl
InChI=1SC21H13ClO4Sc112892719(12)111820(23)157613(1017(15)2618)2521(24)14423516(14)22h211H1H3b1811
MFCD04155761
O=C1C(=Cc2sccc2C)Oc2c1ccc(c2)OC(=O)c1ccccc1Cl
ZINC000013758265
ZINC13758265

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Available files

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