Vitas-M small molecule compound

(4E)-5-(4-tert-butylphenyl)-4-[(4-chlorophenyl)(hydroxy)methylidene]-1-(6-methoxy-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione

Catalog ID
STL036843
SMILES COc1ccc2c(c1)sc(n2)N1C(c2ccc(cc2)C(C)(C)C)/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C1=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 C29H25ClN2O4S MW 533.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25ClN2O4S/c1-29(2,3)18-9-5-16(6-10-18)24-23(25(33)17-7-11-19(30)12-8-17)26(34)27(35)32(24)28-31-21-14-13-20(36-4)15-22(21)37-28/h5-15,24,33H,1-4H3/b25-23+
InChIKey
ZRLANRKKPIYIMK-WJTDDFOZSA-N
Synonyms
446278-11-1
(4E)5(4tertbutylphenyl)4((4chlorophenyl)(hydroxy)methylidene)1(6methoxy13benzothiazol2yl)pyrrolidine23dione
(4E)5(4TERTBUTYLPHENYL)4((4CHLOROPHENYL)HYDROXYMETHYLIDENE)1(6METHOXY13BENZOTHIAZOL2YL)PYRROLIDINE23DIONE
446278111
5(4(TERTBUTYL)PHENYL)4((4CHLOROPHENYL)CARBONYL)3HYDROXY1(6METHOXYBENZOTHIAZOL2YL)3PYRROLIN2ONE
CC(C)(C)C1=CC=C(C=C1)C2C(=C(C3=CC=C(C=C3)Cl)O)C(=O)C(=O)N2C4=NC5=C(S4)C=C(C=C5)OC
COc1ccc2c(c1)sc(n2)N1C(c2ccc(cc2)C(C)(C)C)C(=C(c2ccc(cc2)Cl)O)C(=O)C1=O
InChI=1SC29H25ClN2O4Sc129(23)189516(61018)2423(25(33)1771119(30)12817)26(34)27(35)32(24)283121141320(364)1522(21)3728h5152433H14H3b2523+
MFCD03810705
ZINC000102856725
ZINC000102856728

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Available files

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