Vitas-M small molecule compound

(E)-[2-(2,4-dichlorophenyl)-4,5-dioxo-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene](phenyl)methanolate

Catalog ID
STL038476
SMILES Clc1ccc(c(c1)Cl)C1/C(=C(/c2ccccc2)\[O-])/C(=O)C(=O)N1Cc1ccc[nH+]c1

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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 C23H16Cl2N2O3 MW 439.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16Cl2N2O3/c24-16-8-9-17(18(25)11-16)20-19(21(28)15-6-2-1-3-7-15)22(29)23(30)27(20)13-14-5-4-10-26-12-14/h1-12,20,28H,13H2/b21-19+
InChIKey
KTVQIUIZLKMUFG-XUTLUUPISA-N
Synonyms
423753-97-3
(4E)5(24DICHLOROPHENYL)4(HYDROXY(PHENYL)METHYLIDENE)1(PYRIDIN3YLMETHYL)PYRROLIDINE23DIONE
(E)(2(24DICHLOROPHENYL)45DIOXO1(PYRIDIN1IUM3YLMETHYL)PYRROLIDIN3YLIDENE)PHENYLMETHANOLATE
(E)(2(24dichlorophenyl)45dioxo1(pyridinium3ylmethyl)pyrrolidin3ylidene)(phenyl)methanolate
423753973
C1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CC3=CN=CC=C3)C4=C(C=C(C=C4)Cl)Cl)O
Clc1ccc(c(c1)Cl)C1C(=C(c2ccccc2)(O))C(=O)C(=O)N1Cc1ccc(nH+)c1
InChI=1SC23H16Cl2N2O3c24168917(18(25)1116)2019(21(28)156213715)22(29)23(30)27(20)13145410261214h1122028H13H2b2119+
MFCD18247634
ZINC000102861246
ZINC000102861247

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Available files

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