Vitas-M small molecule compound
(E)-(4-methoxy-3-methylphenyl){1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxo-2-phenylpyrrolidin-3-ylidene}methanolate
Catalog ID
STL147612
SMILES COc1ccc(cc1C)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1)CCC[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 C26H30N2O5 MW 450.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30N2O5/c1-18-17-20(9-10-21(18)32-2)24(29)22-23(19-7-4-3-5-8-19)28(26(31)25(22)30)12-6-11-27-13-15-33-16-14-27/h3-5,7-10,17,23,29H,6,11-16H2,1-2H3/b24-22+InChIKey
SNDGNSKURRRQCY-ZNTNEXAZSA-NSynonyms
460045-94-7(4E)4(HYDROXY(4METHOXY3METHYLPHENYL)METHYLIDENE)1(3MORPHOLIN4YLPROPYL)5PHENYLPYRROLIDINE23DIONE
(E)(4methoxy3methylphenyl)(1(3(morpholin4ium4yl)propyl)45dioxo2phenylpyrrolidin3ylidene)methanolate
(E)(4METHOXY3METHYLPHENYL)(1(3MORPHOLIN4IUM4YLPROPYL)45DIOXO2PHENYLPYRROLIDIN3YLIDENE)METHANOLATE
3HYDROXY4(4METHOXY3METHYLBENZOYL)1(3(4MORPHOLINYL)PROPYL)5PHENYL15DIHYDRO2HPYRROL2ONE
460045947
CC1=C(C=CC(=C1)C(=C2C(N(C(=O)C2=O)CCC(NH+)3CCOCC3)C4=CC=CC=C4)(O))OC
COc1ccc(cc1C)C(=C1C(=O)C(=O)N(C1c1ccccc1)CCC(NH+)1CCOCC1)(O)
InChI=1SC26H30N2O5c1181720(91021(18)322)24(29)2223(197435819)28(26(31)25(22)30)1261127131533161427h35710172329H61116H212H3b2422+
MFCD20755232
ZINC000102925743
ZINC000102925746
Check stock
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Check stock on Vitas-MAvailable files
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