Vitas-M small molecule compound

(E)-(3-chloro-4-ethoxyphenyl){2-(4-chlorophenyl)-1-[3-(dimethylammonio)propyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate

Catalog ID
STL150164
SMILES CCOc1ccc(cc1Cl)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)Cl)CCC[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 C24H26Cl2N2O4 MW 477.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26Cl2N2O4/c1-4-32-19-11-8-16(14-18(19)26)22(29)20-21(15-6-9-17(25)10-7-15)28(24(31)23(20)30)13-5-12-27(2)3/h6-11,14,21,29H,4-5,12-13H2,1-3H3/b22-20+
InChIKey
CORYHCMSNHTIIU-LSDHQDQOSA-N
Synonyms
636988-67-5
(4E)4((3CHLORO4ETHOXYPHENYL)HYDROXYMETHYLIDENE)5(4CHLOROPHENYL)1(3(DIMETHYLAMINO)PROPYL)PYRROLIDINE23DIONE
(E)(3chloro4ethoxyphenyl)(2(4chlorophenyl)1(3(dimethylammonio)propyl)45dioxopyrrolidin3ylidene)methanolate
(E)(3CHLORO4ETHOXYPHENYL)(2(4CHLOROPHENYL)1(3(DIMETHYLAZANIUMYL)PROPYL)45DIOXOPYRROLIDIN3YLIDENE)METHANOLATE
1(3(DIMETHYLAMINO)PROPYL)4((3CHLORO4ETHOXYPHENYL)CARBONYL)5(4CHLOROPHENYL)3HYDROXY3PYRROLIN2ONE
636988675
CCOC1=C(C=C(C=C1)C(=C2C(N(C(=O)C2=O)CCCN(C)C)C3=CC=C(C=C3)Cl)O)Cl
CCOc1ccc(cc1Cl)C(=C1C(=O)C(=O)N(C1c1ccc(cc1)Cl)CCC(NH+)(C)C)(O)
InChI=1SC24H26Cl2N2O4c14321911816(1418(19)26)22(29)2021(156917(25)10715)28(24(31)23(20)30)1351227(2)3h611142129H451213H213H3b2220+
MFCD20755758
ZINC000102930676
ZINC000102930678

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Available files

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