Vitas-M small molecule compound

(4E)-1-(6-ethyl-1,3-benzothiazol-2-yl)-4-[(4-fluorophenyl)(hydroxy)methylidene]-5-[4-(propan-2-yloxy)phenyl]pyrrolidine-2,3-dione

Catalog ID
STK610883
SMILES CCc1ccc2c(c1)sc(n2)N1C(=O)C(=O)/C(=C(\c2ccc(cc2)F)/O)/C1c1ccc(cc1)OC(C)C

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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 C29H25FN2O4S MW 516.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25FN2O4S/c1-4-17-5-14-22-23(15-17)37-29(31-22)32-25(18-8-12-21(13-9-18)36-16(2)3)24(27(34)28(32)35)26(33)19-6-10-20(30)11-7-19/h5-16,25,33H,4H2,1-3H3/b26-24+
InChIKey
GBTQDECLEMFBBU-SHHOIMCASA-N
Synonyms
618420-85-2
(4E)1(6ethyl13benzothiazol2yl)4((4fluorophenyl)(hydroxy)methylidene)5(4(propan2yloxy)phenyl)pyrrolidine23dione
(4E)1(6ETHYL13BENZOTHIAZOL2YL)4((4FLUOROPHENYL)HYDROXYMETHYLIDENE)5(4PROPAN2YLOXYPHENYL)PYRROLIDINE23DIONE
1(6ETHYLBENZOTHIAZOL2YL)4((4FLUOROPHENYL)CARBONYL)3HYDROXY5(4(METHYLETHOXY)PHENYL)3PYRROLIN2ONE
618420852
CCC1=CC2=C(C=C1)N=C(S2)N3C(C(=C(C4=CC=C(C=C4)F)O)C(=O)C3=O)C5=CC=C(C=C5)OC(C)C
CCc1ccc2c(c1)sc(n2)N1C(=O)C(=O)C(=C(c2ccc(cc2)F)O)C1c1ccc(cc1)OC(C)C
InChI=1SC29H25FN2O4Sc14175142223(1517)3729(3122)3225(1881221(13918)3616(2)3)24(27(34)28(32)35)26(33)1961020(30)11719h5162533H4H213H3b2624+
MFCD08734127
ZINC000102707658
ZINC000102707663

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Available files

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