Vitas-M small molecule compound
(E)-[2-(4-chlorophenyl)-4,5-dioxo-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene](4-propoxyphenyl)methanolate
Catalog ID
STK559022
SMILES CCCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)Cl)Cc1ccc[nH+]c1)/[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 C26H23ClN2O4 MW 462.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23ClN2O4/c1-2-14-33-21-11-7-19(8-12-21)24(30)22-23(18-5-9-20(27)10-6-18)29(26(32)25(22)31)16-17-4-3-13-28-15-17/h3-13,15,23,30H,2,14,16H2,1H3/b24-22+InChIKey
LIESFAVWWGYDQZ-ZNTNEXAZSA-NSynonyms
636989-53-2(E)(2(4chlorophenyl)45dioxo1(pyridinium3ylmethyl)pyrrolidin3ylidene)(4propoxyphenyl)methanolate
636989532
CCCOC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CC3=CN=CC=C3)C4=CC=C(C=C4)Cl)O
CCCOc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1ccc(cc1)Cl)Cc1ccc(nH+)c1)(O)
InChI=1SC26H23ClN2O4c1214332111719(81221)24(30)2223(185920(27)10618)29(26(32)25(22)31)16174313281517h313152330H21416H21H3b2422+
MFCD08732886
ZINC000102484030
ZINC000102484039
Check stock
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