Vitas-M small molecule compound
(5E)-1-benzyl-2,6-dioxo-5-[(1-propyl-1,2,3,4-tetrahydroquinolinium-6-yl)methylidene]-1,2,5,6-tetrahydropyrimidin-4-olate
Catalog ID
STL055192
SMILES CCC[NH+]1CCCc2c1ccc(c2)/C=C/1\C(=NC(=O)N(C1=O)Cc1ccccc1)[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 C24H25N3O3 MW 403.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N3O3/c1-2-12-26-13-6-9-19-14-18(10-11-21(19)26)15-20-22(28)25-24(30)27(23(20)29)16-17-7-4-3-5-8-17/h3-5,7-8,10-11,14-15H,2,6,9,12-13,16H2,1H3,(H,25,28,30)/b20-15+InChIKey
PVKGUFFFSWQHAZ-HMMYKYKNSA-NSynonyms
847245-42-5(5E)1benzyl26dioxo5((1propyl1234tetrahydroquinolinium6yl)methylidene)1256tetrahydropyrimidin4olate
(5E)1BENZYL5((1PROPYL34DIHYDRO2HQUINOLIN6YL)METHYLIDENE)13DIAZINANE246TRIONE
847245425
CCC(NH+)1CCCc2c1ccc(c2)C=C1C(=NC(=O)N(C1=O)Cc1ccccc1)(O)
CCCN1CCCC2=C1C=CC(=C2)C=C3C(=O)NC(=O)N(C3=O)CC4=CC=CC=C4
InChI=1SC24H25N3O3c1212261369191418(101121(19)26)152022(28)2524(30)27(23(20)29)16177435817h357810111415H269121316H21H3(H252830)b2015+
MFCD18249659
ZINC000005643222
ZINC5643222
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