Vitas-M small molecule compound
(2E)-7-methyl-2-[(1-methyl-1H-indol-3-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl 4-methylbenzenesulfonate
Catalog ID
STK993060
SMILES Cc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1C)O/C(=C/c1cn(c3c1cccc3)C)/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 C26H21NO5S MW 459.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21NO5S/c1-16-8-10-19(11-9-16)33(29,30)32-23-13-12-21-25(28)24(31-26(21)17(23)2)14-18-15-27(3)22-7-5-4-6-20(18)22/h4-15H,1-3H3/b24-14+InChIKey
WNJKIFGWFLQJLV-ZVHZXABRSA-NSynonyms
929418-95-1((2E)7methyl2((1methylindol3yl)methylidene)3oxo1benzofuran6yl)4methylbenzenesulfonate
(2E)7methyl2((1methyl1Hindol3yl)methylidene)3oxo23dihydro1benzofuran6yl4methylbenzenesulfonate
(E)7methyl2((1methyl1Hindol3yl)methylene)3oxo23dihydrobenzofuran6yl4methylbenzenesulfonate
7METHYL2((1METHYLINDOL3YL)METHYLENE)3OXOBENZO(34B)FURAN6YL4METHYLBENZENESULFONATE
929418951
CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C3=C(C=C2)C(=O)C(=CC4=CN(C5=CC=CC=C54)C)O3)C
Cc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1C)OC(=Cc1cn(c3c1cccc3)C)C2=O
InChI=1SC26H21NO5Sc11681019(11916)33(2930)322313122125(28)24(3126(21)17(23)2)14181527(3)22754620(18)22h415H13H3b2414+
MFCD09844870
ZINC000009422201
ZINC09422201
ZINC9422201
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