Vitas-M small molecule compound
(E)-{1-[3-(dimethylammonio)propyl]-4,5-dioxo-2-(3-propoxyphenyl)pyrrolidin-3-ylidene}(pyridin-4-yl)methanolate
Catalog ID
STK563970
SMILES CCCOc1cccc(c1)C1/C(=C(/c2ccncc2)\[O-])/C(=O)C(=O)N1CCC[NH+](C)C
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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 C24H29N3O4 MW 423.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H29N3O4/c1-4-15-31-19-8-5-7-18(16-19)21-20(22(28)17-9-11-25-12-10-17)23(29)24(30)27(21)14-6-13-26(2)3/h5,7-12,16,21,28H,4,6,13-15H2,1-3H3/b22-20+InChIKey
GNGMEXJSEWPCJZ-LSDHQDQOSA-NSynonyms
627487-96-1(4E)1(3(DIMETHYLAMINO)PROPYL)4(HYDROXY(PYRIDIN4YL)METHYLIDENE)5(3PROPOXYPHENYL)PYRROLIDINE23DIONE
(E)(1(3(dimethylammonio)propyl)45dioxo2(3propoxyphenyl)pyrrolidin3ylidene)(pyridin4yl)methanolate
(E)(1(3(DIMETHYLAZANIUMYL)PROPYL)45DIOXO2(3PROPOXYPHENYL)PYRROLIDIN3YLIDENE)PYRIDIN4YLMETHANOLATE
1(3(DIMETHYLAMINO)PROPYL)3HYDROXY5(3PROPOXYPHENYL)4(4PYRIDYLCARBONYL)3PYRROLIN2ONE
627487961
CCCOC1=CC=CC(=C1)C2C(=C(C3=CC=NC=C3)(O))C(=O)C(=O)N2CCC(NH+)(C)C
CCCOc1cccc(c1)C1C(=C(c2ccncc2)(O))C(=O)C(=O)N1CCC(NH+)(C)C
InChI=1SC24H29N3O4c1415311985718(1619)2120(22(28)1791125121017)23(29)24(30)27(21)1461326(2)3h5712162128H461315H213H3b2220+
MFCD18244429
ZINC000102524861
ZINC000102524866
Check stock
See real-time availability and sample size for STK563970 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.