Vitas-M small molecule compound
(4E)-4-[(4-ethoxyphenyl)(hydroxy)methylidene]-1-(6-ethyl-1,3-benzothiazol-2-yl)-5-phenylpyrrolidine-2,3-dione
Catalog ID
STL051960
SMILES CCOc1ccc(cc1)/C(=C\1/C(c2ccccc2)N(C(=O)C1=O)c1sc2c(n1)ccc(c2)CC)/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/c1-3-17-10-15-21-22(16-17)35-28(29-21)30-24(18-8-6-5-7-9-18)23(26(32)27(30)33)25(31)19-11-13-20(14-12-19)34-4-2/h5-16,24,31H,3-4H2,1-2H3/b25-23+InChIKey
KNUAAKBPLFWAKV-WJTDDFOZSA-NSynonyms
618423-25-9(4E)4((4ethoxyphenyl)(hydroxy)methylidene)1(6ethyl13benzothiazol2yl)5phenylpyrrolidine23dione
(4E)4((4ETHOXYPHENYL)HYDROXYMETHYLIDENE)1(6ETHYL13BENZOTHIAZOL2YL)5PHENYLPYRROLIDINE23DIONE
618423259
CCC1=CC2=C(C=C1)N=C(S2)N3C(C(=C(C4=CC=C(C=C4)OCC)O)C(=O)C3=O)C5=CC=CC=C5
CCOc1ccc(cc1)C(=C1C(c2ccccc2)N(C(=O)C1=O)c1sc2c(n1)ccc(c2)CC)O
InChI=1SC28H24N2O4Sc131710152122(1617)3528(2921)3024(188657918)23(26(32)27(30)33)25(31)19111320(141219)3442h5162431H34H212H3b2523+
MFCD05738607
ZINC000102889746
ZINC000102889747
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