Vitas-M small molecule compound
(E)-{2-(4-chlorophenyl)-1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxopyrrolidin-3-ylidene}[4-(prop-2-en-1-yloxy)phenyl]methanolate
Catalog ID
STL038069
SMILES C=CCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)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 C26H27ClN2O5 MW 482.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27ClN2O5/c1-2-15-34-21-9-5-19(6-10-21)24(30)22-23(18-3-7-20(27)8-4-18)29(26(32)25(22)31)12-11-28-13-16-33-17-14-28/h2-10,23,30H,1,11-17H2/b24-22+InChIKey
KQXBTHNFEUIENJ-ZNTNEXAZSA-NSynonyms
636990-69-7(4E)5(4CHLOROPHENYL)4(HYDROXY(4PROP2ENOXYPHENYL)METHYLIDENE)1(2MORPHOLIN4YLETHYL)PYRROLIDINE23DIONE
(E)(2(4chlorophenyl)1(2(morpholin4ium4yl)ethyl)45dioxopyrrolidin3ylidene)(4(prop2en1yloxy)phenyl)methanolate
(E)(2(4CHLOROPHENYL)1(2MORPHOLIN4IUM4YLETHYL)45DIOXOPYRROLIDIN3YLIDENE)(4PROP2ENOXYPHENYL)METHANOLATE
5(4CHLOROPHENYL)3HYDROXY1(2MORPHOLIN4YLETHYL)4((4PROP2ENYLOXYPHENYL)CARBONYL)3PYRROLIN2ONE
636990697
C=CCOC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CC(NH+)3CCOCC3)C4=CC=C(C=C4)Cl)(O)
C=CCOc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1ccc(cc1)Cl)CC(NH+)1CCOCC1)(O)
InChI=1SC26H27ClN2O5c121534219519(61021)24(30)2223(183720(27)8418)29(26(32)25(22)31)121128131633171428h2102330H11117H2b2422+
MFCD18247550
ZINC000101287396
ZINC000101287397
Check stock
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Check stock on Vitas-MAvailable files
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