Vitas-M small molecule compound

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

Catalog ID
STK631072
SMILES CN(CCN1C(c2ccc(cc2)[N+](=O)[O-])/C(=C(/c2ccc(cc2)OCc2cccc(c2)C)\O)/C(=O)C1=O)C

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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 C29H29N3O6 MW 515.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29N3O6/c1-19-5-4-6-20(17-19)18-38-24-13-9-22(10-14-24)27(33)25-26(21-7-11-23(12-8-21)32(36)37)31(16-15-30(2)3)29(35)28(25)34/h4-14,17,26,33H,15-16,18H2,1-3H3/b27-25+
InChIKey
SASPNPZESNLNKF-IMVLJIQESA-N
Synonyms
839704-73-3
(4E)1(2(dimethylamino)ethyl)4(hydroxy(4((3methylbenzyl)oxy)phenyl)methylidene)5(4nitrophenyl)pyrrolidine23dione
(4E)1(2(dimethylamino)ethyl)4(hydroxy(4((3methylphenyl)methoxy)phenyl)methylidene)5(4nitrophenyl)pyrrolidine23dione
(4E)1(2DIMETHYLAMINOETHYL)4(HYDROXY(4((3METHYLPHENYL)METHOXY)PHENYL)METHYLIDENE)5(4NITROPHENYL)PYRROLIDINE23DIONE
839704733
CC1=CC(=CC=C1)COC2=CC=C(C=C2)C(=C3C(N(C(=O)C3=O)CCN(C)C)C4=CC=C(C=C4)(N+)(=O)(O))O
CN(CCN1C(c2ccc(cc2)(N+)(=O)(O))C(=C(c2ccc(cc2)OCc2cccc(c2)C)O)C(=O)C1=O)C
InChI=1SC29H29N3O6c11954620(1719)18382413922(101424)27(33)2526(2171123(12821)32(36)37)31(161530(2)3)29(35)28(25)34h414172633H151618H213H3b2725+
MFCD09798517
ZINC000102734567
ZINC000102734570

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Available files

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