Vitas-M small molecule compound
(2Z)-2-[(3-methylthiophen-2-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl 4-tert-butylbenzoate
Catalog ID
STK924134
SMILES O=C(c1ccc(cc1)C(C)(C)C)Oc1ccc2c(c1)O/C(=C\c1sccc1C)/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 C25H22O4S MW 418.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22O4S/c1-15-11-12-30-22(15)14-21-23(26)19-10-9-18(13-20(19)29-21)28-24(27)16-5-7-17(8-6-16)25(2,3)4/h5-14H,1-4H3/b21-14-InChIKey
JTQQBVQRXRYDDH-STZFKDTASA-NSynonyms
622790-44-7((2Z)2((3METHYLTHIOPHEN2YL)METHYLIDENE)3OXO1BENZOFURAN6YL)4TERTBUTYLBENZOATE
(2Z)2((3methylthiophen2yl)methylidene)3oxo23dihydro1benzofuran6yl4tertbutylbenzoate
(Z)2((3methylthiophen2yl)methylene)3oxo23dihydrobenzofuran6yl4(tertbutyl)benzoate
2((3METHYL(2THIENYL))METHYLENE)3OXOBENZO(34B)FURAN6YL4(TERTBUTYL)BENZOATE
622790447
CC1=C(SC=C1)C=C2C(=O)C3=C(O2)C=C(C=C3)OC(=O)C4=CC=C(C=C4)C(C)(C)C
InChI=1SC25H22O4Sc11511123022(15)142123(26)1910918(1320(19)2921)2824(27)165717(8616)25(23)4h514H14H3b2114
MFCD04155996
O=C(c1ccc(cc1)C(C)(C)C)Oc1ccc2c(c1)OC(=Cc1sccc1C)C2=O
ZINC000013758302
ZINC13758302
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