Vitas-M small molecule compound
(4E)-4-[hydroxy(4-methylphenyl)methylidene]-5-(4-methoxyphenyl)-1-(6-methyl-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Catalog ID
STL147637
SMILES COc1ccc(cc1)C1/C(=C(/c2ccc(cc2)C)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)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 C27H22N2O4S MW 470.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22N2O4S/c1-15-4-7-18(8-5-15)24(30)22-23(17-9-11-19(33-3)12-10-17)29(26(32)25(22)31)27-28-20-13-6-16(2)14-21(20)34-27/h4-14,23,30H,1-3H3/b24-22+InChIKey
UGCUQDFAOPVILW-ZNTNEXAZSA-NSynonyms
514188-85-3(4E)4(hydroxy(4methylphenyl)methylidene)5(4methoxyphenyl)1(6methyl13benzothiazol2yl)pyrrolidine23dione
3HYDROXY5(4METHOXYPHENYL)1(6METHYLBENZOTHIAZOL2YL)4((4METHYLPHENYL)CARBONYL)3PYRROLIN2ONE
514188853
CC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)C3=NC4=C(S3)C=C(C=C4)C)C5=CC=C(C=C5)OC)O
COc1ccc(cc1)C1C(=C(c2ccc(cc2)C)O)C(=O)C(=O)N1c1sc2c(n1)ccc(c2)C
InChI=1SC27H22N2O4Sc1154718(8515)24(30)2223(1791119(333)121017)29(26(32)25(22)31)27282013616(2)1421(20)3427h4142330H13H3b2422+
MFCD03797317
ZINC000102925448
ZINC000102925450
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