Vitas-M small molecule compound

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

Catalog ID
STK564430
SMILES CCOc1ccc2c(c1)sc(n2)N1C(=O)C(=O)/C(=C(\c2ccc(cc2)OC)/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 C29H26N2O7S MW 546.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26N2O7S/c1-5-38-19-10-12-21-23(15-19)39-29(30-21)31-25(20-14-18(36-3)11-13-22(20)37-4)24(27(33)28(31)34)26(32)16-6-8-17(35-2)9-7-16/h6-15,25,32H,5H2,1-4H3/b26-24+
InChIKey
XAYIFVDGZWAHQA-SHHOIMCASA-N
Synonyms
514193-35-2
(4E)5(25dimethoxyphenyl)1(6ethoxy13benzothiazol2yl)4(hydroxy(4methoxyphenyl)methylidene)pyrrolidine23dione
5(25DIMETHOXYPHENYL)1(6ETHOXYBENZOTHIAZOL2YL)3HYDROXY4((4METHOXYPHENYL)CARBONYL)3PYRROLIN2ONE
514193352
CCOC1=CC2=C(C=C1)N=C(S2)N3C(C(=C(C4=CC=C(C=C4)OC)O)C(=O)C3=O)C5=C(C=CC(=C5)OC)OC
CCOc1ccc2c(c1)sc(n2)N1C(=O)C(=O)C(=C(c2ccc(cc2)OC)O)C1c1cc(OC)ccc1OC
InChI=1SC29H26N2O7Sc15381910122123(1519)3929(3021)3125(201418(363)111322(20)374)24(27(33)28(31)34)26(32)166817(352)9716h6152532H5H214H3b2624+
MFCD03810806
ZINC000102527804
ZINC000102527810

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Available files

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