Vitas-M small molecule compound
ethyl 2-[(3E)-3-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-2-(4-methoxyphenyl)-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STL042915
SMILES CCOC(=O)c1sc(nc1C)N1C(=O)C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/O)/C1c1ccc(cc1)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 C27H24N2O8S MW 536.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24N2O8S/c1-4-35-26(33)24-14(2)28-27(38-24)29-21(15-5-8-17(34-3)9-6-15)20(23(31)25(29)32)22(30)16-7-10-18-19(13-16)37-12-11-36-18/h5-10,13,21,30H,4,11-12H2,1-3H3/b22-20+InChIKey
BJYTVSJEUFYFSQ-LSDHQDQOSA-NSynonyms
620562-47-2620562472
CCOC(=O)C1=C(N=C(S1)N2C(C(=C(C3=CC4=C(C=C3)OCCO4)O)C(=O)C2=O)C5=CC=C(C=C5)OC)C
CCOC(=O)c1sc(nc1C)N1C(=O)C(=O)C(=C(c2ccc3c(c2)OCCO3)O)C1c1ccc(cc1)OC
ethyl2((3E)3(23dihydro14benzodioxin6yl(hydroxy)methylidene)2(4methoxyphenyl)45dioxopyrrolidin1yl)4methyl13thiazole5carboxylate
InChI=1SC27H24N2O8Sc143526(33)2414(2)2827(3824)2921(155817(343)9615)20(23(31)25(29)32)22(30)167101819(1316)3712113618h510132130H41112H213H3b2220+
MFCD05732403
ZINC000102871905
ZINC000102871909
Check stock
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Check stock on Vitas-MAvailable files
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