Vitas-M small molecule compound
(E)-(4-methylphenyl){1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxo-2-(pyridin-3-yl)pyrrolidin-3-ylidene}methanolate
Catalog ID
STK566753
SMILES Cc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccnc1)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 C23H25N3O4 MW 407.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N3O4/c1-16-4-6-17(7-5-16)21(27)19-20(18-3-2-8-24-15-18)26(23(29)22(19)28)10-9-25-11-13-30-14-12-25/h2-8,15,20,27H,9-14H2,1H3/b21-19+InChIKey
DJINHFQVLWSMNF-XUTLUUPISA-NSynonyms
381702-55-2(4E)4(HYDROXY(4METHYLPHENYL)METHYLIDENE)1(2MORPHOLIN4YLETHYL)5PYRIDIN3YLPYRROLIDINE23DIONE
(E)(4methylphenyl)(1(2(morpholin4ium4yl)ethyl)45dioxo2(pyridin3yl)pyrrolidin3ylidene)methanolate
(E)(4METHYLPHENYL)(1(2MORPHOLIN4IUM4YLETHYL)45DIOXO2PYRIDIN3YLPYRROLIDIN3YLIDENE)METHANOLATE
381702552
3HYDROXY4((4METHYLPHENYL)CARBONYL)1(2(MORPHOLIN4YL)ETHYL)5(PYRIDIN3YL)25DIHYDRO1HPYRROL2ONE
CC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CCN3CCOCC3)C4=CN=CC=C4)O
Cc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1cccnc1)CC(NH+)1CCOCC1)(O)
InChI=1SC23H25N3O4c1164617(7516)21(27)1920(18328241518)26(23(29)22(19)28)10925111330141225h28152027H914H21H3b2119+
MFCD18245092
ZINC000102650568
ZINC000102650571
Check stock
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Check stock on Vitas-MAvailable files
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