Vitas-M small molecule compound
methyl 2-[(3E)-3-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-2-(4-methoxyphenyl)-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STL050173
SMILES COC(=O)c1sc(nc1C)N1C(c2ccc(cc2)OC)/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C1=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 C27H24N2O7S MW 520.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24N2O7S/c1-13-11-17-12-16(7-10-19(17)36-13)22(30)20-21(15-5-8-18(34-3)9-6-15)29(25(32)23(20)31)27-28-14(2)24(37-27)26(33)35-4/h5-10,12-13,21,30H,11H2,1-4H3/b22-20+InChIKey
ODWIXSKISJGWPU-LSDHQDQOSA-NSynonyms
849918-88-3849918883
CC1CC2=C(O1)C=CC(=C2)C(=C3C(N(C(=O)C3=O)C4=NC(=C(S4)C(=O)OC)C)C5=CC=C(C=C5)OC)O
COC(=O)c1sc(nc1C)N1C(c2ccc(cc2)OC)C(=C(c2ccc3c(c2)CC(O3)C)O)C(=O)C1=O
InChI=1SC27H24N2O7Sc11311171216(71019(17)3613)22(30)2021(155818(343)9615)29(25(32)23(20)31)272814(2)24(3727)26(33)354h51012132130H11H214H3b2220+
methyl2((3E)3(hydroxy(2methyl23dihydro1benzofuran5yl)methylidene)2(4methoxyphenyl)45dioxopyrrolidin1yl)4methyl13thiazole5carboxylate
MFCD05734348
ZINC000102886528
ZINC000102886532
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Check stock on Vitas-MAvailable files
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