Vitas-M small molecule compound

(4E)-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-[hydroxy(3-methoxyphenyl)methylidene]-5-(4-methylphenyl)pyrrolidine-2,3-dione

Catalog ID
STK624224
SMILES COc1cccc(c1)/C(=C\1/C(c2ccc(cc2)C)N(C(=O)C1=O)c1nc2c(s1)cc(cc2C)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 C28H24N2O4S MW 484.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24N2O4S/c1-15-8-10-18(11-9-15)24-22(25(31)19-6-5-7-20(14-19)34-4)26(32)27(33)30(24)28-29-23-17(3)12-16(2)13-21(23)35-28/h5-14,24,31H,1-4H3/b25-22+
InChIKey
GEZVQAUBYYYLCQ-YYDJUVGSSA-N
Synonyms
607687-94-5
(4E)1(46dimethyl13benzothiazol2yl)4(hydroxy(3methoxyphenyl)methylidene)5(4methylphenyl)pyrrolidine23dione
1(46DIMETHYLBENZOTHIAZOL2YL)3HYDROXY4((3METHOXYPHENYL)CARBONYL)5(4METHYLPHENYL)3PYRROLIN2ONE
607687945
CC1=CC=C(C=C1)C2C(=C(C3=CC(=CC=C3)OC)O)C(=O)C(=O)N2C4=NC5=C(C=C(C=C5S4)C)C
COc1cccc(c1)C(=C1C(c2ccc(cc2)C)N(C(=O)C1=O)c1nc2c(s1)cc(cc2C)C)O
InChI=1SC28H24N2O4Sc11581018(11915)2422(25(31)1965720(1419)344)26(32)27(33)30(24)28292317(3)1216(2)1321(23)3528h5142431H14H3b2522+
MFCD09789844
ZINC000102725614
ZINC000102725618

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Available files

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