Vitas-M small molecule compound
(E)-(3-chloro-4-ethoxyphenyl){1-[3-(dimethylammonio)propyl]-2-(3-methoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}methanolate
Catalog ID
STK558806
SMILES CCOc1ccc(cc1Cl)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)OC)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 C25H29ClN2O5 MW 472.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29ClN2O5/c1-5-33-20-11-10-17(15-19(20)26)23(29)21-22(16-8-6-9-18(14-16)32-4)28(25(31)24(21)30)13-7-12-27(2)3/h6,8-11,14-15,22,29H,5,7,12-13H2,1-4H3/b23-21+InChIKey
PHNBFXXCEKQRHX-XTQSDGFTSA-NSynonyms
636988-64-2(4E)4((3CHLORO4ETHOXYPHENYL)HYDROXYMETHYLIDENE)1(3(DIMETHYLAMINO)PROPYL)5(3METHOXYPHENYL)PYRROLIDINE23DIONE
(4Z)4((3CHLORO4ETHOXYPHENYL)HYDROXYMETHYLIDENE)1(3(DIMETHYLAMINO)PROPYL)5(3METHOXYPHENYL)PYRROLIDINE23DIONE
(E)(3chloro4ethoxyphenyl)(1(3(dimethylammonio)propyl)2(3methoxyphenyl)45dioxopyrrolidin3ylidene)methanolate
(E)(3CHLORO4ETHOXYPHENYL)(1(3(DIMETHYLAZANIUMYL)PROPYL)2(3METHOXYPHENYL)45DIOXOPYRROLIDIN3YLIDENE)METHANOLATE
1(3(DIMETHYLAMINO)PROPYL)4((3CHLORO4ETHOXYPHENYL)CARBONYL)3HYDROXY5(3METHOXYPHENYL)3PYRROLIN2ONE
4(3CHLORO4ETHOXYBENZOYL)1(3(DIMETHYLAMINO)PROPYL)3HYDROXY5(3METHOXYPHENYL)15DIHYDRO2HPYRROL2ONE
636988642
CCOC1=C(C=C(C=C1)C(=C2C(N(C(=O)C2=O)CCCN(C)C)C3=CC(=CC=C3)OC)O)Cl
CCOc1ccc(cc1Cl)C(=C1C(=O)C(=O)N(C1c1cccc(c1)OC)CCC(NH+)(C)C)(O)
InChI=1SC25H29ClN2O5c153320111017(1519(20)26)23(29)2122(1686918(1416)324)28(25(31)24(21)30)1371227(2)3h681114152229H571213H214H3b2321+
MFCD18243115
ZINC000102482432
ZINC000102482440
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