Vitas-M small molecule compound
(E)-(4-chlorophenyl)[4,5-dioxo-2-(3-phenoxyphenyl)-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene]methanolate
Catalog ID
STK559998
SMILES Clc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)Oc1ccccc1)Cc1ccc[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 C29H21ClN2O4 MW 496.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H21ClN2O4/c30-22-13-11-20(12-14-22)27(33)25-26(32(29(35)28(25)34)18-19-6-5-15-31-17-19)21-7-4-10-24(16-21)36-23-8-2-1-3-9-23/h1-17,26,33H,18H2/b27-25+InChIKey
NQHJHEACMBQKLI-IMVLJIQESA-NSynonyms
(4E)4((4CHLOROPHENYL)HYDROXYMETHYLIDENE)5(3PHENOXYPHENYL)1(PYRIDIN3YLMETHYL)PYRROLIDINE23DIONE
(E)(4CHLOROPHENYL)(45DIOXO2(3PHENOXYPHENYL)1(PYRIDIN1IUM3YLMETHYL)PYRROLIDIN3YLIDENE)METHANOLATE
(E)(4chlorophenyl)(45dioxo2(3phenoxyphenyl)1(pyridinium3ylmethyl)pyrrolidin3ylidene)methanolate
C1=CC=C(C=C1)OC2=CC=CC(=C2)C3C(=C(C4=CC=C(C=C4)Cl)(O))C(=O)C(=O)N3CC5=C(NH+)=CC=C5
Clc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1cccc(c1)Oc1ccccc1)Cc1ccc(nH+)c1)(O)
InChI=1SC29H21ClN2O4c3022131120(121422)27(33)2526(32(29(35)28(25)34)18196515311719)21741024(1621)36238213923h1172633H18H2b2725+
MFCD18243425
ZINC000102492124
ZINC000102492136
Check stock
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