Vitas-M small molecule compound
(4E)-1-(6-ethyl-1,3-benzothiazol-2-yl)-4-[hydroxy(phenyl)methylidene]-5-(4-methoxyphenyl)pyrrolidine-2,3-dione
Catalog ID
STK603058
SMILES CCc1ccc2c(c1)sc(n2)N1C(c2ccc(cc2)OC)/C(=C(/c2ccccc2)\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 C27H22N2O4S MW 470.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22N2O4S/c1-3-16-9-14-20-21(15-16)34-27(28-20)29-23(17-10-12-19(33-2)13-11-17)22(25(31)26(29)32)24(30)18-7-5-4-6-8-18/h4-15,23,30H,3H2,1-2H3/b24-22+InChIKey
BQEMCPDHAPKXAT-ZNTNEXAZSA-NSynonyms
618418-79-4(4E)1(6ethyl13benzothiazol2yl)4(hydroxy(phenyl)methylidene)5(4methoxyphenyl)pyrrolidine23dione
1(6ETHYLBENZOTHIAZOL2YL)3HYDROXY5(4METHOXYPHENYL)4(PHENYLCARBONYL)3PYRROLIN2ONE
618418794
CCC1=CC2=C(C=C1)N=C(S2)N3C(C(=C(C4=CC=CC=C4)O)C(=O)C3=O)C5=CC=C(C=C5)OC
CCc1ccc2c(c1)sc(n2)N1C(c2ccc(cc2)OC)C(=C(c2ccccc2)O)C(=O)C1=O
InChI=1SC27H22N2O4Sc13169142021(1516)3427(2820)2923(17101219(332)131117)22(25(31)26(29)32)24(30)187546818h4152330H3H212H3b2422+
MFCD08737076
ZINC000102695029
ZINC000102695034
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