Vitas-M small molecule compound
(E)-{2-[4-(dimethylamino)phenyl]-4,5-dioxo-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene}{4-[(2-methylbenzyl)oxy]phenyl}methanolate
Catalog ID
STK568216
SMILES CN(c1ccc(cc1)C1/C(=C(/c2ccc(cc2)OCc2ccccc2C)\[O-])/C(=O)C(=O)N1Cc1ccc[nH+]c1)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 C33H31N3O4 MW 533.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H31N3O4/c1-22-7-4-5-9-26(22)21-40-28-16-12-25(13-17-28)31(37)29-30(24-10-14-27(15-11-24)35(2)3)36(33(39)32(29)38)20-23-8-6-18-34-19-23/h4-19,30,37H,20-21H2,1-3H3/b31-29+InChIKey
OAQSHCBKPZGRDM-OWWNRXNESA-NSynonyms
850763-15-4(4E)5(4DIMETHYLAMINOPHENYL)4(HYDROXY(4((2METHYLPHENYL)METHOXY)PHENYL)METHYLIDENE)1(PYRIDIN3YLMETHYL)PYRROLIDINE23DIONE
(E)(2(4(dimethylamino)phenyl)45dioxo1(pyridin1ium3ylmethyl)pyrrolidin3ylidene)(4((2methylphenyl)methoxy)phenyl)methanolate
(E)(2(4(dimethylamino)phenyl)45dioxo1(pyridinium3ylmethyl)pyrrolidin3ylidene)(4((2methylbenzyl)oxy)phenyl)methanolate
(E)(2(4DIMETHYLAMINOPHENYL)45DIOXO1(PYRIDIN1IUM3YLMETHYL)PYRROLIDIN3YLIDENE)(4((2METHYLPHENYL)METHOXY)PHENYL)METHANOLATE
850763154
CC1=CC=CC=C1COC2=CC=C(C=C2)C(=C3C(N(C(=O)C3=O)CC4=C(NH+)=CC=C4)C5=CC=C(C=C5)N(C)C)(O)
CN(c1ccc(cc1)C1C(=C(c2ccc(cc2)OCc2ccccc2C)(O))C(=O)C(=O)N1Cc1ccc(nH+)c1)C
InChI=1SC33H31N3O4c122745926(22)214028161225(131728)31(37)2930(24101427(151124)35(2)3)36(33(39)32(29)38)20238618341923h4193037H2021H213H3b3129+
MFCD18245214
ZINC000102551169
ZINC000102551179
Check stock
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