Vitas-M small molecule compound
(E)-{2-(4-chlorophenyl)-1-[3-(1H-imidazol-3-ium-1-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}(phenyl)methanolate
Catalog ID
STL044739
SMILES Clc1ccc(cc1)C1N(CCCn2c[nH+]cc2)C(=O)C(=O)/C/1=C(\c1ccccc1)/[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 C23H20ClN3O3 MW 421.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20ClN3O3/c24-18-9-7-16(8-10-18)20-19(21(28)17-5-2-1-3-6-17)22(29)23(30)27(20)13-4-12-26-14-11-25-15-26/h1-3,5-11,14-15,20,28H,4,12-13H2/b21-19+InChIKey
JBSITHXZPKMWGY-XUTLUUPISA-NSynonyms
381717-91-5(4E)5(4CHLOROPHENYL)4(HYDROXY(PHENYL)METHYLIDENE)1(3IMIDAZOL1YLPROPYL)PYRROLIDINE23DIONE
(E)(2(4chlorophenyl)1(3(1Himidazol3ium1yl)propyl)45dioxopyrrolidin3ylidene)(phenyl)methanolate
381717915
4BENZOYL5(4CHLOROPHENYL)3HYDROXY1(3(1HIMIDAZOL1YL)PROPYL)25DIHYDRO1HPYRROL2ONE
C1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CCCN3C=CN=C3)C4=CC=C(C=C4)Cl)O
Clc1ccc(cc1)C1N(CCCn2c(nH+)cc2)C(=O)C(=O)C1=C(c1ccccc1)(O)
InChI=1SC23H20ClN3O3c24189716(81018)2019(21(28)175213617)22(29)23(30)27(20)13412261411251526h1351114152028H41213H2b2119+
MFCD18248475
ZINC000102875930
ZINC000102875932
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