Vitas-M small molecule compound
(E)-{1-[2-(dimethylammonio)ethyl]-4,5-dioxo-2-phenylpyrrolidin-3-ylidene}{4-[(3-methylbenzyl)oxy]phenyl}methanolate
Catalog ID
STL052550
SMILES C[NH+](CCN1C(c2ccccc2)/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 C29H30N2O4 MW 470.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30N2O4/c1-20-8-7-9-21(18-20)19-35-24-14-12-23(13-15-24)27(32)25-26(22-10-5-4-6-11-22)31(17-16-30(2)3)29(34)28(25)33/h4-15,18,26,32H,16-17,19H2,1-3H3/b27-25+InChIKey
BWZUWHNZXDGMPM-IMVLJIQESA-NSynonyms
836625-47-9(4E)1(2(dimethylamino)ethyl)4(hydroxy(4((3methylphenyl)methoxy)phenyl)methylidene)5phenylpyrrolidine23dione
(4E)1(2DIMETHYLAMINOETHYL)4(HYDROXY(4((3METHYLPHENYL)METHOXY)PHENYL)METHYLIDENE)5PHENYLPYRROLIDINE23DIONE
(E)(1(2(dimethylammonio)ethyl)45dioxo2phenylpyrrolidin3ylidene)(4((3methylbenzyl)oxy)phenyl)methanolate
(E)(1(2(DIMETHYLAZANIUMYL)ETHYL)45DIOXO2PHENYLPYRROLIDIN3YLIDENE)(4((3METHYLPHENYL)METHOXY)PHENYL)METHANOLATE
836625479
C(NH+)(CCN1C(c2ccccc2)C(=C(c2ccc(cc2)OCc2cccc(c2)C)(O))C(=O)C1=O)C
CC1=CC(=CC=C1)COC2=CC=C(C=C2)C(=C3C(N(C(=O)C3=O)CCN(C)C)C4=CC=CC=C4)O
InChI=1SC29H30N2O4c12087921(1820)193524141223(131524)27(32)2526(22105461122)31(171630(2)3)29(34)28(25)33h415182632H161719H213H3b2725+
MFCD18249473
ZINC000102890216
ZINC000102890218
Check stock
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Check stock on Vitas-MAvailable files
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