Vitas-M small molecule compound

(E)-{1-[3-(1H-imidazol-3-ium-1-yl)propyl]-4,5-dioxo-2-phenylpyrrolidin-3-ylidene}(3-methoxyphenyl)methanolate

Catalog ID
STL149562
SMILES COc1cccc(c1)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1)CCCn1cc[nH+]c1)/[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 C24H23N3O4 MW 417.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23N3O4/c1-31-19-10-5-9-18(15-19)22(28)20-21(17-7-3-2-4-8-17)27(24(30)23(20)29)13-6-12-26-14-11-25-16-26/h2-5,7-11,14-16,21,28H,6,12-13H2,1H3/b22-20+
InChIKey
WFZCCSLCURXDNQ-LSDHQDQOSA-N
Synonyms
609315-87-9
(4E)4(HYDROXY(3METHOXYPHENYL)METHYLIDENE)1(3IMIDAZOL1YLPROPYL)5PHENYLPYRROLIDINE23DIONE
(E)(1(3(1Himidazol3ium1yl)propyl)45dioxo2phenylpyrrolidin3ylidene)(3methoxyphenyl)methanolate
3HYDROXY1(3(1HIMIDAZOL1YL)PROPYL)4(3METHOXYBENZOYL)5PHENYL15DIHYDRO2HPYRROL2ONE
3HYDROXY1(3IMIDAZOLYLPROPYL)4((3METHOXYPHENYL)CARBONYL)5PHENYL3PYRROLIN2ONE
609315879
COC1=CC=CC(=C1)C(=C2C(N(C(=O)C2=O)CCCN3C=CN=C3)C4=CC=CC=C4)O
COc1cccc(c1)C(=C1C(=O)C(=O)N(C1c1ccccc1)CCCn1cc(nH+)c1)(O)
InChI=1SC24H23N3O4c13119105918(1519)22(28)2021(177324817)27(24(30)23(20)29)13612261411251626h2571114162128H61213H21H3b2220+
MFCD20755627
ZINC000102929991
ZINC000102929992

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Available files

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