Vitas-M small molecule compound

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

Catalog ID
STK613453
SMILES COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1OC)OC)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 C29H26N2O6S MW 530.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26N2O6S/c1-5-16-9-14-20-22(15-16)38-29(30-20)31-24(19-7-6-8-21(36-3)27(19)37-4)23(26(33)28(31)34)25(32)17-10-12-18(35-2)13-11-17/h6-15,24,32H,5H2,1-4H3/b25-23+
InChIKey
IATIELKGORBCNB-WJTDDFOZSA-N
Synonyms
618421-75-3
(4E)5(23dimethoxyphenyl)1(6ethyl13benzothiazol2yl)4(hydroxy(4methoxyphenyl)methylidene)pyrrolidine23dione
5(23DIMETHOXYPHENYL)1(6ETHYLBENZOTHIAZOL2YL)3HYDROXY4((4METHOXYPHENYL)CARBONYL)3PYRROLIN2ONE
618421753
CCC1=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
COc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1cccc(c1OC)OC)c1sc2c(n1)ccc(c2)CC)O
InChI=1SC29H26N2O6Sc15169142022(1516)3829(3020)3124(1976821(363)27(19)374)23(26(33)28(31)34)25(32)17101218(352)131117h6152432H5H214H3b2523+
MFCD08730823
ZINC000102711401
ZINC000102711404

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Available files

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