Vitas-M small molecule compound
ethyl 2-[(3E)-3-[hydroxy(4-propoxyphenyl)methylidene]-4,5-dioxo-2-(thiophen-2-yl)pyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STL147879
SMILES CCCOc1ccc(cc1)/C(=C\1/C(c2cccs2)N(C(=O)C1=O)c1sc(c(n1)C)C(=O)OCC)/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 C25H24N2O6S2 MW 512.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N2O6S2/c1-4-12-33-16-10-8-15(9-11-16)20(28)18-19(17-7-6-13-34-17)27(23(30)21(18)29)25-26-14(3)22(35-25)24(31)32-5-2/h6-11,13,19,28H,4-5,12H2,1-3H3/b20-18+InChIKey
VUTVBDFXVIPBKM-CZIZESTLSA-NSynonyms
835910-53-7835910537
CCCOC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)C3=NC(=C(S3)C(=O)OCC)C)C4=CC=CS4)O
CCCOc1ccc(cc1)C(=C1C(c2cccs2)N(C(=O)C1=O)c1sc(c(n1)C)C(=O)OCC)O
ethyl2((3E)3(hydroxy(4propoxyphenyl)methylidene)45dioxo2(thiophen2yl)pyrrolidin1yl)4methyl13thiazole5carboxylate
ETHYL2((4E)4(HYDROXY(4PROPOXYPHENYL)METHYLIDENE)23DIOXO5THIOPHEN2YLPYRROLIDIN1YL)4METHYL13THIAZOLE5CARBOXYLATE
InChI=1SC25H24N2O6S2c1412331610815(91116)20(28)1819(1776133417)27(23(30)21(18)29)252614(3)22(3525)24(31)3252h611131928H4512H213H3b2018+
MFCD03803553
ZINC000102926170
ZINC000102926173
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