Vitas-M small molecule compound
(E)-{2-(3,4-dichlorophenyl)-1-[2-(dimethylammonio)ethyl]-4,5-dioxopyrrolidin-3-ylidene}(4-methoxy-2-methylphenyl)methanolate
Catalog ID
STL046792
SMILES COc1ccc(c(c1)C)/C(=C/1\C(=O)C(=O)N(C1c1ccc(c(c1)Cl)Cl)CC[NH+](C)C)/[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 C23H24Cl2N2O4 MW 463.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24Cl2N2O4/c1-13-11-15(31-4)6-7-16(13)21(28)19-20(14-5-8-17(24)18(25)12-14)27(10-9-26(2)3)23(30)22(19)29/h5-8,11-12,20,28H,9-10H2,1-4H3/b21-19+InChIKey
VGXUZDIGZIKULA-XUTLUUPISA-NSynonyms
371140-67-9(4E)5(34DICHLOROPHENYL)1(2DIMETHYLAMINOETHYL)4(HYDROXY(4METHOXY2METHYLPHENYL)METHYLIDENE)PYRROLIDINE23DIONE
(E)(2(34dichlorophenyl)1(2(dimethylammonio)ethyl)45dioxopyrrolidin3ylidene)(4methoxy2methylphenyl)methanolate
(E)(2(34DICHLOROPHENYL)1(2(DIMETHYLAZANIUMYL)ETHYL)45DIOXOPYRROLIDIN3YLIDENE)(4METHOXY2METHYLPHENYL)METHANOLATE
371140679
CC1=C(C=CC(=C1)OC)C(=C2C(N(C(=O)C2=O)CC(NH+)(C)C)C3=CC(=C(C=C3)Cl)Cl)(O)
COc1ccc(c(c1)C)C(=C1C(=O)C(=O)N(C1c1ccc(c(c1)Cl)Cl)CC(NH+)(C)C)(O)
InChI=1SC23H24Cl2N2O4c1131115(314)6716(13)21(28)1920(145817(24)18(25)1214)27(10926(2)3)23(30)22(19)29h5811122028H910H214H3b2119+
MFCD18248925
ZINC000102882187
ZINC000102882190
Check stock
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Check stock on Vitas-MAvailable files
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