Vitas-M small molecule compound

(4E)-1-[2-(dimethylamino)ethyl]-5-(3-ethoxy-4-hydroxyphenyl)-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)pyrrolidine-2,3-dione

Catalog ID
STK603744
SMILES CCOc1cc(ccc1O)C1N(CCN(C)C)C(=O)C(=O)/C/1=C(\c1ccc(cc1)OCc1cccc(c1)C)/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 C31H34N2O6 MW 530.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H34N2O6/c1-5-38-26-18-23(11-14-25(26)34)28-27(30(36)31(37)33(28)16-15-32(3)4)29(35)22-9-12-24(13-10-22)39-19-21-8-6-7-20(2)17-21/h6-14,17-18,28,34-35H,5,15-16,19H2,1-4H3/b29-27+
InChIKey
XDKFOABZGZAXCX-ORIPQNMZSA-N
Synonyms
840455-32-5
(4E)1(2(dimethylamino)ethyl)5(3ethoxy4hydroxyphenyl)4(hydroxy(4((3methylbenzyl)oxy)phenyl)methylidene)pyrrolidine23dione
(4E)1(2(dimethylamino)ethyl)5(3ethoxy4hydroxyphenyl)4(hydroxy(4((3methylphenyl)methoxy)phenyl)methylidene)pyrrolidine23dione
(4E)1(2DIMETHYLAMINOETHYL)5(3ETHOXY4HYDROXYPHENYL)4(HYDROXY(4((3METHYLPHENYL)METHOXY)PHENYL)METHYLIDENE)PYRROLIDINE23DIONE
840455325
CCOC1=C(C=CC(=C1)C2C(=C(C3=CC=C(C=C3)OCC4=CC=CC(=C4)C)O)C(=O)C(=O)N2CCN(C)C)O
CCOc1cc(ccc1O)C1N(CCN(C)C)C(=O)C(=O)C1=C(c1ccc(cc1)OCc1cccc(c1)C)O
InChI=1SC31H34N2O6c1538261823(111425(26)34)2827(30(36)31(37)33(28)161532(3)4)29(35)2291224(131022)39192186720(2)1721h6141718283435H5151619H214H3b2927+
MFCD08737163
ZINC000102696184
ZINC000102696187

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Available files

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