Vitas-M small molecule compound
(E)-{1-[3-(diethylammonio)propyl]-2-(2,3-dimethoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}[5-(methoxycarbonyl)-2,4-dimethyl-1H-pyrrol-3-yl]methanolate
Catalog ID
STL044244
SMILES CC[NH+](CCCN1C(=O)C(=O)/C(=C(\c2c(C)[nH]c(c2C)C(=O)OC)/[O-])/C1c1cccc(c1OC)OC)CC
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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 C28H37N3O7 MW 527.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H37N3O7/c1-8-30(9-2)14-11-15-31-23(18-12-10-13-19(36-5)26(18)37-6)21(25(33)27(31)34)24(32)20-16(3)22(28(35)38-7)29-17(20)4/h10,12-13,23,29,32H,8-9,11,14-15H2,1-7H3/b24-21+InChIKey
LIAFSJAZMDQIPG-DARPEHSRSA-NSynonyms
797015-91-9(E)(1(3(diethylammonio)propyl)2(23dimethoxyphenyl)45dioxopyrrolidin3ylidene)(5(methoxycarbonyl)24dimethyl1Hpyrrol3yl)methanolate
(E)(1(3(DIETHYLAZANIUMYL)PROPYL)2(23DIMETHOXYPHENYL)45DIOXOPYRROLIDIN3YLIDENE)(5METHOXYCARBONYL24DIMETHYL1HPYRROL3YL)METHANOLATE
797015919
CC(NH+)(CCCN1C(=O)C(=O)C(=C(c2c(C)(nH)c(c2C)C(=O)OC)(O))C1c1cccc(c1OC)OC)CC
CCN(CC)CCCN1C(C(=C(C2=C(NC(=C2C)C(=O)OC)C)O)C(=O)C1=O)C3=C(C(=CC=C3)OC)OC
InChI=1SC28H37N3O7c1830(92)1411153123(1812101319(365)26(18)376)21(25(33)27(31)34)24(32)2016(3)22(28(35)387)2917(20)4h101213232932H89111415H217H3b2421+
METHYL4((E)(1(3(DIETHYLAMINO)PROPYL)2(23DIMETHOXYPHENYL)45DIOXOPYRROLIDIN3YLIDENE)HYDROXYMETHYL)35DIMETHYL1HPYRROLE2CARBOXYLATE
MFCD18248376
ZINC000102874023
ZINC000102874026
Check stock
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Check stock on Vitas-MAvailable files
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