Vitas-M small molecule compound
(E)-{1-[2-(dimethylammonio)ethyl]-4,5-dioxo-2-(pyridin-4-yl)pyrrolidin-3-ylidene}(4-propoxyphenyl)methanolate
Catalog ID
STL045830
SMILES CCCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccncc1)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 C23H27N3O4 MW 409.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N3O4/c1-4-15-30-18-7-5-17(6-8-18)21(27)19-20(16-9-11-24-12-10-16)26(14-13-25(2)3)23(29)22(19)28/h5-12,20,27H,4,13-15H2,1-3H3/b21-19+InChIKey
MHLIJCCWAKHZJF-XUTLUUPISA-NSynonyms
(4E)1(2DIMETHYLAMINOETHYL)4(HYDROXY(4PROPOXYPHENYL)METHYLIDENE)5PYRIDIN4YLPYRROLIDINE23DIONE
(E)(1(2(dimethylammonio)ethyl)45dioxo2(pyridin4yl)pyrrolidin3ylidene)(4propoxyphenyl)methanolate
(E)(1(2(DIMETHYLAZANIUMYL)ETHYL)45DIOXO2PYRIDIN4YLPYRROLIDIN3YLIDENE)(4PROPOXYPHENYL)METHANOLATE
1(2(DIMETHYLAMINO)ETHYL)3HYDROXY4((4PROPOXYPHENYL)CARBONYL)5(4PYRIDYL)3PYRROLIN2ONE
CCCOC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CC(NH+)(C)C)C3=CC=NC=C3)(O)
CCCOc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1ccncc1)CC(NH+)(C)C)(O)
InChI=1SC23H27N3O4c141530187517(6818)21(27)1920(1691124121016)26(141325(2)3)23(29)22(19)28h5122027H41315H213H3b2119+
MFCD18248719
ZINC000102878810
ZINC000102878814
Check stock
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Check stock on Vitas-MAvailable files
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