Vitas-M small molecule compound
(E)-{1-[3-(diethylammonio)propyl]-2-(3,4-dimethoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}[5-(methoxycarbonyl)-2,4-dimethyl-1H-pyrrol-3-yl]methanolate
Catalog ID
STL149817
SMILES CC[NH+](CCCN1C(=O)C(=O)/C(=C(\c2c(C)[nH]c(c2C)C(=O)OC)/[O-])/C1c1ccc(c(c1)OC)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)13-10-14-31-24(18-11-12-19(36-5)20(15-18)37-6)22(26(33)27(31)34)25(32)21-16(3)23(28(35)38-7)29-17(21)4/h11-12,15,24,29,32H,8-10,13-14H2,1-7H3/b25-22+InChIKey
UIPRMKVECLWHSN-YYDJUVGSSA-NSynonyms
797798-25-5(E)(1(3(diethylammonio)propyl)2(34dimethoxyphenyl)45dioxopyrrolidin3ylidene)(5(methoxycarbonyl)24dimethyl1Hpyrrol3yl)methanolate
(E)(1(3(DIETHYLAZANIUMYL)PROPYL)2(34DIMETHOXYPHENYL)45DIOXOPYRROLIDIN3YLIDENE)(5METHOXYCARBONYL24DIMETHYL1HPYRROL3YL)METHANOLATE
797798255
CC(NH+)(CC)CCCN1C(C(=C(C2=C(NC(=C2C)C(=O)OC)C)(O))C(=O)C1=O)C3=CC(=C(C=C3)OC)OC
CC(NH+)(CCCN1C(=O)C(=O)C(=C(c2c(C)(nH)c(c2C)C(=O)OC)(O))C1c1ccc(c(c1)OC)OC)CC
InChI=1SC28H37N3O7c1830(92)1310143124(18111219(365)20(1518)376)22(26(33)27(31)34)25(32)2116(3)23(28(35)387)2917(21)4h111215242932H8101314H217H3b2522+
METHYL4((E)(1(3(DIETHYLAMINO)PROPYL)2(34DIMETHOXYPHENYL)45DIOXOPYRROLIDIN3YLIDENE)HYDROXYMETHYL)35DIMETHYL1HPYRROLE2CARBOXYLATE
MFCD20755680
ZINC000102929243
ZINC000102929246
Check stock
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Check stock on Vitas-MAvailable files
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