Vitas-M small molecule compound
(E)-{1-[3-(dimethylammonio)propyl]-4,5-dioxo-2-(thiophen-2-yl)pyrrolidin-3-ylidene}(3-methoxyphenyl)methanolate
Catalog ID
STK566207
SMILES COc1cccc(c1)/C(=C/1\C(=O)C(=O)N(C1c1cccs1)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 C21H24N2O4S MW 400.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O4S/c1-22(2)10-6-11-23-18(16-9-5-12-28-16)17(20(25)21(23)26)19(24)14-7-4-8-15(13-14)27-3/h4-5,7-9,12-13,18,24H,6,10-11H2,1-3H3/b19-17+InChIKey
RYODNAMSMWNZQR-HTXNQAPBSA-NSynonyms
608497-99-0(4E)1(3(DIMETHYLAMINO)PROPYL)4(HYDROXY(3METHOXYPHENYL)METHYLIDENE)5THIOPHEN2YLPYRROLIDINE23DIONE
(E)(1(3(dimethylammonio)propyl)45dioxo2(thiophen2yl)pyrrolidin3ylidene)(3methoxyphenyl)methanolate
(E)(1(3(DIMETHYLAZANIUMYL)PROPYL)45DIOXO2THIOPHEN2YLPYRROLIDIN3YLIDENE)(3METHOXYPHENYL)METHANOLATE
608497990
CN(C)CCCN1C(C(=C(C2=CC(=CC=C2)OC)O)C(=O)C1=O)C3=CC=CS3
COc1cccc(c1)C(=C1C(=O)C(=O)N(C1c1cccs1)CCC(NH+)(C)C)(O)
InChI=1SC21H24N2O4Sc122(2)106112318(1695122816)17(20(25)21(23)26)19(24)1474815(1314)273h457912131824H61011H213H3b1917+
MFCD18244975
ZINC000005408683
ZINC000005408693
Check stock
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Check stock on Vitas-MAvailable files
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