Vitas-M small molecule compound
(E)-{2-(3-chlorophenyl)-1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxopyrrolidin-3-ylidene}(4-propoxyphenyl)methanolate
Catalog ID
STL047560
SMILES CCCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)Cl)CC[NH+]1CCOCC1)/[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 C26H29ClN2O5 MW 484.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29ClN2O5/c1-2-14-34-21-8-6-18(7-9-21)24(30)22-23(19-4-3-5-20(27)17-19)29(26(32)25(22)31)11-10-28-12-15-33-16-13-28/h3-9,17,23,30H,2,10-16H2,1H3/b24-22+InChIKey
WQAMNLOEXFZXOB-ZNTNEXAZSA-NSynonyms
615276-30-7(4E)5(3CHLOROPHENYL)4(HYDROXY(4PROPOXYPHENYL)METHYLIDENE)1(2MORPHOLIN4YLETHYL)PYRROLIDINE23DIONE
(E)(2(3chlorophenyl)1(2(morpholin4ium4yl)ethyl)45dioxopyrrolidin3ylidene)(4propoxyphenyl)methanolate
(E)(2(3CHLOROPHENYL)1(2MORPHOLIN4IUM4YLETHYL)45DIOXOPYRROLIDIN3YLIDENE)(4PROPOXYPHENYL)METHANOLATE
5(3CHLOROPHENYL)3HYDROXY1(2MORPHOLIN4YLETHYL)4((4PROPOXYPHENYL)CARBONYL)3PYRROLIN2ONE
615276307
CCCOC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CCN3CCOCC3)C4=CC(=CC=C4)Cl)O
CCCOc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1cccc(c1)Cl)CC(NH+)1CCOCC1)(O)
InChI=1SC26H29ClN2O5c121434218618(7921)24(30)2223(1943520(27)1719)29(26(32)25(22)31)111028121533161328h39172330H21016H21H3b2422+
MFCD18249097
ZINC000102882718
ZINC000102882720
Check stock
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Check stock on Vitas-MAvailable files
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