Vitas-M small molecule compound
(E)-{1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxo-2-(thiophen-2-yl)pyrrolidin-3-ylidene}[4-(prop-2-en-1-yloxy)phenyl]methanolate
Catalog ID
STK563373
SMILES C=CCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccs1)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 C24H26N2O5S MW 454.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26N2O5S/c1-2-13-31-18-7-5-17(6-8-18)22(27)20-21(19-4-3-16-32-19)26(24(29)23(20)28)10-9-25-11-14-30-15-12-25/h2-8,16,21,27H,1,9-15H2/b22-20+InChIKey
NALDDJULAGAMHQ-LSDHQDQOSA-NSynonyms
615272-19-0(4E)4(HYDROXY(4PROP2ENOXYPHENYL)METHYLIDENE)1(2MORPHOLIN4YLETHYL)5THIOPHEN2YLPYRROLIDINE23DIONE
(E)(1(2(morpholin4ium4yl)ethyl)45dioxo2(thiophen2yl)pyrrolidin3ylidene)(4(prop2en1yloxy)phenyl)methanolate
(E)(1(2MORPHOLIN4IUM4YLETHYL)45DIOXO2THIOPHEN2YLPYRROLIDIN3YLIDENE)(4PROP2ENOXYPHENYL)METHANOLATE
3HYDROXY1(2MORPHOLIN4YLETHYL)4((4PROP2ENYLOXYPHENYL)CARBONYL)5(2THIENYL)3PYRROLIN2ONE
615272190
C=CCOC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CCN3CCOCC3)C4=CC=CS4)O
C=CCOc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1cccs1)CC(NH+)1CCOCC1)(O)
InChI=1SC24H26N2O5Sc121331187517(6818)22(27)2021(1943163219)26(24(29)23(20)28)10925111430151225h28162127H1915H2b2220+
MFCD18244280
ZINC000101288224
ZINC000101288227
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.