Vitas-M small molecule compound

(4E)-5-(2,5-dimethoxyphenyl)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[(4-fluorophenyl)(hydroxy)methylidene]pyrrolidine-2,3-dione

Catalog ID
STL044181
SMILES CCOc1ccc2c(c1)sc(n2)N1C(=O)C(=O)/C(=C(\c2ccc(cc2)F)/O)/C1c1cc(OC)ccc1OC

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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 C28H23FN2O6S MW 534.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23FN2O6S/c1-4-37-18-9-11-20-22(14-18)38-28(30-20)31-24(19-13-17(35-2)10-12-21(19)36-3)23(26(33)27(31)34)25(32)15-5-7-16(29)8-6-15/h5-14,24,32H,4H2,1-3H3/b25-23+
InChIKey
NNMXLJJJKUDOAV-WJTDDFOZSA-N
Synonyms
514193-01-2
(4E)5(25dimethoxyphenyl)1(6ethoxy13benzothiazol2yl)4((4fluorophenyl)(hydroxy)methylidene)pyrrolidine23dione
(4E)5(25DIMETHOXYPHENYL)1(6ETHOXY13BENZOTHIAZOL2YL)4((4FLUOROPHENYL)HYDROXYMETHYLIDENE)PYRROLIDINE23DIONE
5(25DIMETHOXYPHENYL)1(6ETHOXYBENZOTHIAZOL2YL)4((4FLUOROPHENYL)CARBONYL)3HYDROXY3PYRROLIN2ONE
514193012
CCOC1=CC2=C(C=C1)N=C(S2)N3C(C(=C(C4=CC=C(C=C4)F)O)C(=O)C3=O)C5=C(C=CC(=C5)OC)OC
CCOc1ccc2c(c1)sc(n2)N1C(=O)C(=O)C(=C(c2ccc(cc2)F)O)C1c1cc(OC)ccc1OC
InChI=1SC28H23FN2O6Sc1437189112022(1418)3828(3020)3124(191317(352)101221(19)363)23(26(33)27(31)34)25(32)155716(29)8615h5142432H4H213H3b2523+
MFCD03805675
ZINC000102873888
ZINC000102873890

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Available files

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