Vitas-M small molecule compound
(4E)-4-[hydroxy(4-methoxyphenyl)methylidene]-5-(4-methylphenyl)-1-(5-methyl-1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione
Catalog ID
STK846102
SMILES COc1ccc(cc1)/C(=C\1/C(c2ccc(cc2)C)N(C(=O)C1=O)c1nnc(s1)C)/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 C22H19N3O4S MW 421.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N3O4S/c1-12-4-6-14(7-5-12)18-17(19(26)15-8-10-16(29-3)11-9-15)20(27)21(28)25(18)22-24-23-13(2)30-22/h4-11,18,26H,1-3H3/b19-17+InChIKey
CUDZLHPMQSOLGO-HTXNQAPBSA-NSynonyms
(4E)4(hydroxy(4methoxyphenyl)methylidene)5(4methylphenyl)1(5methyl134thiadiazol2yl)pyrrolidine23dione
3HYDROXY4((4METHOXYPHENYL)CARBONYL)1(5METHYL134THIADIAZOL2YL)5(4METHYLPHENYL)25DIHYDRO1HPYRROL2ONE
3HYDROXY4(4METHOXYBENZOYL)5(4METHYLPHENYL)1(5METHYL134THIADIAZOL2YL)15DIHYDRO2HPYRROL2ONE
CC1=CC=C(C=C1)C2C(=C(C3=CC=C(C=C3)OC)O)C(=O)C(=O)N2C4=NN=C(S4)C
COc1ccc(cc1)C(=C1C(c2ccc(cc2)C)N(C(=O)C1=O)c1nnc(s1)C)O
InChI=1SC22H19N3O4Sc1124614(7512)1817(19(26)1581016(293)11915)20(27)21(28)25(18)22242313(2)3022h4111826H13H3b1917+
MFCD03813244
ZINC000102798761
ZINC000102798763
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