Vitas-M small molecule compound
(E)-[4-(benzyloxy)-2-methylphenyl]{1-[3-(dimethylammonio)propyl]-2-(4-methylphenyl)-4,5-dioxopyrrolidin-3-ylidene}methanolate
Catalog ID
STL150239
SMILES C[NH+](CCCN1C(c2ccc(cc2)C)/C(=C(/c2ccc(cc2C)OCc2ccccc2)\[O-])/C(=O)C1=O)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 C31H34N2O4 MW 498.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H34N2O4/c1-21-11-13-24(14-12-21)28-27(30(35)31(36)33(28)18-8-17-32(3)4)29(34)26-16-15-25(19-22(26)2)37-20-23-9-6-5-7-10-23/h5-7,9-16,19,28,34H,8,17-18,20H2,1-4H3/b29-27+InChIKey
DWMPGVMNGDYFHK-ORIPQNMZSA-NSynonyms
(4E)1(3(DIMETHYLAMINO)PROPYL)4(HYDROXY(2METHYL4PHENYLMETHOXYPHENYL)METHYLIDENE)5(4METHYLPHENYL)PYRROLIDINE23DIONE
(E)(1(3(DIMETHYLAZANIUMYL)PROPYL)2(4METHYLPHENYL)45DIOXOPYRROLIDIN3YLIDENE)(2METHYL4PHENYLMETHOXYPHENYL)METHANOLATE
(E)(4(benzyloxy)2methylphenyl)(1(3(dimethylammonio)propyl)2(4methylphenyl)45dioxopyrrolidin3ylidene)methanolate
C(NH+)(CCCN1C(c2ccc(cc2)C)C(=C(c2ccc(cc2C)OCc2ccccc2)(O))C(=O)C1=O)C
CC1=CC=C(C=C1)C2C(=C(C3=C(C=C(C=C3)OCC4=CC=CC=C4)C)O)C(=O)C(=O)N2CCCN(C)C
InChI=1SC31H34N2O4c121111324(141221)2827(30(35)31(36)33(28)1881732(3)4)29(34)26161525(1922(26)2)37202396571023h57916192834H8171820H214H3b2927+
MFCD20755777
ZINC000102930779
ZINC000102930781
Check stock
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Check stock on Vitas-MAvailable files
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