Vitas-M small molecule compound
(4E)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-5-(2-fluorophenyl)-4-[hydroxy(4-methoxyphenyl)methylidene]pyrrolidine-2,3-dione
Catalog ID
STL149708
SMILES CCOc1ccc2c(c1)sc(n2)N1C(=O)C(=O)/C(=C(\c2ccc(cc2)OC)/O)/C1c1ccccc1F
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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 C27H21FN2O5S MW 504.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21FN2O5S/c1-3-35-17-12-13-20-21(14-17)36-27(29-20)30-23(18-6-4-5-7-19(18)28)22(25(32)26(30)33)24(31)15-8-10-16(34-2)11-9-15/h4-14,23,31H,3H2,1-2H3/b24-22+InChIKey
UKKORBBHMFSLRY-ZNTNEXAZSA-NSynonyms
514193-21-6(4E)1(6ethoxy13benzothiazol2yl)5(2fluorophenyl)4(hydroxy(4methoxyphenyl)methylidene)pyrrolidine23dione
1(6ETHOXYBENZOTHIAZOL2YL)5(2FLUOROPHENYL)3HYDROXY4((4METHOXYPHENYL)CARBONYL)3PYRROLIN2ONE
514193216
CCOC1=CC2=C(C=C1)N=C(S2)N3C(C(=C(C4=CC=C(C=C4)OC)O)C(=O)C3=O)C5=CC=CC=C5F
CCOc1ccc2c(c1)sc(n2)N1C(=O)C(=O)C(=C(c2ccc(cc2)OC)O)C1c1ccccc1F
InChI=1SC27H21FN2O5Sc13351712132021(1417)3627(2920)3023(18645719(18)28)22(25(32)26(30)33)24(31)1581016(342)11915h4142331H3H212H3b2422+
MFCD03795908
ZINC000102929790
ZINC000102929791
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