Vitas-M small molecule compound
methyl 2-[(3E)-3-[hydroxy(3-methoxyphenyl)methylidene]-2-(4-methylphenyl)-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STK622185
SMILES COc1cccc(c1)/C(=C\1/C(c2ccc(cc2)C)N(C(=O)C1=O)c1sc(c(n1)C)C(=O)OC)/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 C25H22N2O6S MW 478.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N2O6S/c1-13-8-10-15(11-9-13)19-18(20(28)16-6-5-7-17(12-16)32-3)21(29)23(30)27(19)25-26-14(2)22(34-25)24(31)33-4/h5-12,19,28H,1-4H3/b20-18+InChIKey
HDNNQAVUWFHOOB-CZIZESTLSA-NSynonyms
608510-03-8608510038
CC1=CC=C(C=C1)C2C(=C(C3=CC(=CC=C3)OC)O)C(=O)C(=O)N2C4=NC(=C(S4)C(=O)OC)C
COc1cccc(c1)C(=C1C(c2ccc(cc2)C)N(C(=O)C1=O)c1sc(c(n1)C)C(=O)OC)O
InChI=1SC25H22N2O6Sc11381015(11913)1918(20(28)1665717(1216)323)21(29)23(30)27(19)252614(2)22(3425)24(31)334h5121928H14H3b2018+
methyl2((3E)3(hydroxy(3methoxyphenyl)methylidene)2(4methylphenyl)45dioxopyrrolidin1yl)4methyl13thiazole5carboxylate
METHYL2(3HYDROXY4((3METHOXYPHENYL)CARBONYL)5(4METHYLPHENYL)2OXO(3PYRROLINYL))4METHYL13THIAZOLE5CARBOXYLATE
MFCD09795099
ZINC000102722168
ZINC000102722173
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