Vitas-M small molecule compound
(4E)-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-[hydroxy(phenyl)methylidene]-5-(3-methoxyphenyl)pyrrolidine-2,3-dione
Catalog ID
STL151114
SMILES COc1cccc(c1)C1N(c2sc3c(n2)c(C)cc(c3)C)C(=O)C(=O)/C/1=C(\c1ccccc1)/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 C27H22N2O4S MW 470.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22N2O4S/c1-15-12-16(2)22-20(13-15)34-27(28-22)29-23(18-10-7-11-19(14-18)33-3)21(25(31)26(29)32)24(30)17-8-5-4-6-9-17/h4-14,23,30H,1-3H3/b24-21+InChIKey
ZFMDVVSLMQVPGL-DARPEHSRSA-NSynonyms
514193-51-2(4E)1(46dimethyl13benzothiazol2yl)4(hydroxy(phenyl)methylidene)5(3methoxyphenyl)pyrrolidine23dione
1(46DIMETHYLBENZOTHIAZOL2YL)3HYDROXY5(3METHOXYPHENYL)4(PHENYLCARBONYL)3PYRROLIN2ONE
514193512
CC1=CC(=C2C(=C1)SC(=N2)N3C(C(=C(C4=CC=CC=C4)O)C(=O)C3=O)C5=CC(=CC=C5)OC)C
COc1cccc(c1)C1N(c2sc3c(n2)c(C)cc(c3)C)C(=O)C(=O)C1=C(c1ccccc1)O
InChI=1SC27H22N2O4Sc1151216(2)2220(1315)3427(2822)2923(181071119(1418)333)21(25(31)26(29)32)24(30)178546917h4142330H13H3b2421+
MFCD03801551
ZINC000102932668
ZINC000102932672
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