Vitas-M small molecule compound

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

Catalog ID
STL045542
SMILES COc1ccc(cc1Cl)/C(=C\1/C(c2ccc(cc2)[N+](=O)[O-])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 C23H18ClN3O6S MW 499.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18ClN3O6S/c1-11-12(2)34-23(25-11)26-19(13-4-7-15(8-5-13)27(31)32)18(21(29)22(26)30)20(28)14-6-9-17(33-3)16(24)10-14/h4-10,19,28H,1-3H3/b20-18+
InChIKey
MHHFCYASJXAFNH-CZIZESTLSA-N
Synonyms
575462-68-9
(4E)4((3chloro4methoxyphenyl)(hydroxy)methylidene)1(45dimethyl13thiazol2yl)5(4nitrophenyl)pyrrolidine23dione
(4E)4((3CHLORO4METHOXYPHENYL)HYDROXYMETHYLIDENE)1(45DIMETHYL13THIAZOL2YL)5(4NITROPHENYL)PYRROLIDINE23DIONE
1(45DIMETHYL(13THIAZOL2YL))4((3CHLORO4METHOXYPHENYL)CARBONYL)3HYDROXY5(4NITROPHENYL)3PYRROLIN2ONE
575462689
CC1=C(SC(=N1)N2C(C(=C(C3=CC(=C(C=C3)OC)Cl)O)C(=O)C2=O)C4=CC=C(C=C4)(N+)(=O)(O))C
COc1ccc(cc1Cl)C(=C1C(c2ccc(cc2)(N+)(=O)(O))N(C(=O)C1=O)c1sc(c(n1)C)C)O
InChI=1SC23H18ClN3O6Sc11112(2)3423(2511)2619(134715(8513)27(31)32)18(21(29)22(26)30)20(28)146917(333)16(24)1014h4101928H13H3b2018+
MFCD03816236
ZINC000102878412
ZINC000102878415

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Available files

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