Vitas-M small molecule compound
(E)-(4-chlorophenyl)[2-(3-chlorophenyl)-4,5-dioxo-1-(pyridinium-2-yl)pyrrolidin-3-ylidene]methanolate
Catalog ID
STK564538
SMILES Clc1cccc(c1)C1/C(=C(/c2ccc(cc2)Cl)\[O-])/C(=O)C(=O)N1c1cccc[nH+]1
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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 C22H14Cl2N2O3 MW 425.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H14Cl2N2O3/c23-15-9-7-13(8-10-15)20(27)18-19(14-4-3-5-16(24)12-14)26(22(29)21(18)28)17-6-1-2-11-25-17/h1-12,19,27H/b20-18+InChIKey
ZWAAUTXRPQCQGQ-CZIZESTLSA-NSynonyms
6237-69-0(4E)5(3CHLOROPHENYL)4((4CHLOROPHENYL)HYDROXYMETHYLIDENE)1PYRIDIN2YLPYRROLIDINE23DIONE
(E)(4chlorophenyl)(2(3chlorophenyl)45dioxo1(pyridinium2yl)pyrrolidin3ylidene)methanolate
2HPYRAN5CARBOXYLICACID3(METHYLTHIO)2OXOMETHYLESTER
6237690
C1=CC=NC(=C1)N2C(C(=C(C3=CC=C(C=C3)Cl)O)C(=O)C2=O)C4=CC(=CC=C4)Cl
Clc1cccc(c1)C1C(=C(c2ccc(cc2)Cl)(O))C(=O)C(=O)N1c1cccc(nH+)1
InChI=1SC22H14Cl2N2O3c23159713(81015)20(27)1819(1443516(24)1214)26(22(29)21(18)28)17612112517h1121927Hb2018+
MFCD18244559
ZINC000102528535
ZINC000102528539
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