Vitas-M small molecule compound

(4E)-5-(4-tert-butylphenyl)-4-[(3-chloro-4-methoxyphenyl)(hydroxy)methylidene]-1-(4,5-dimethyl-1,3-thiazol-2-yl)pyrrolidine-2,3-dione

Catalog ID
STL147857
SMILES COc1ccc(cc1Cl)/C(=C\1/C(c2ccc(cc2)C(C)(C)C)N(C(=O)C1=O)c1sc(c(n1)C)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 C27H27ClN2O4S MW 511.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27ClN2O4S/c1-14-15(2)35-26(29-14)30-22(16-7-10-18(11-8-16)27(3,4)5)21(24(32)25(30)33)23(31)17-9-12-20(34-6)19(28)13-17/h7-13,22,31H,1-6H3/b23-21+
InChIKey
YGLJFLIIEKVIFS-XTQSDGFTSA-N
Synonyms
578000-03-0
(4E)5(4tertbutylphenyl)4((3chloro4methoxyphenyl)(hydroxy)methylidene)1(45dimethyl13thiazol2yl)pyrrolidine23dione
(4E)5(4TERTBUTYLPHENYL)4((3CHLORO4METHOXYPHENYL)HYDROXYMETHYLIDENE)1(45DIMETHYL13THIAZOL2YL)PYRROLIDINE23DIONE
1(45DIMETHYL(13THIAZOL2YL))5(4(TERTBUTYL)PHENYL)4((3CHLORO4METHOXYPHENYL)CARBONYL)3HYDROXY3PYRROLIN2ONE
578000030
CC1=C(SC(=N1)N2C(C(=C(C3=CC(=C(C=C3)OC)Cl)O)C(=O)C2=O)C4=CC=C(C=C4)C(C)(C)C)C
COc1ccc(cc1Cl)C(=C1C(c2ccc(cc2)C(C)(C)C)N(C(=O)C1=O)c1sc(c(n1)C)C)O
InChI=1SC27H27ClN2O4Sc11415(2)3526(2914)3022(1671018(11816)27(34)5)21(24(32)25(30)33)23(31)1791220(346)19(28)1317h7132231H16H3b2321+
MFCD03811892
ZINC000102926503
ZINC000102926505

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Available files

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