Vitas-M small molecule compound

(5E)-5-[1-({[2-hexyl-1-oxo-3-(pyridin-2-yl)-1,2,3,4-tetrahydroisoquinolin-4-yl]methyl}amino)ethylidene]-1-(4-methylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione

Catalog ID
STL485483
SMILES CCCCCCN1C(=O)c2ccccc2C(C1c1ccccn1)CN/C(=C/1\C(=O)NC(=O)N(C1=O)c1ccc(cc1)C)/C

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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 C34H37N5O4 MW 579.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H37N5O4/c1-4-5-6-11-20-38-30(28-14-9-10-19-35-28)27(25-12-7-8-13-26(25)32(38)41)21-36-23(3)29-31(40)37-34(43)39(33(29)42)24-17-15-22(2)16-18-24/h7-10,12-19,27,30,36H,4-6,11,20-21H2,1-3H3,(H,37,40,43)/b29-23+
InChIKey
XHTYYEWEJWBBBN-BYNJWEBRSA-N
Synonyms

(5E)5(1(((2hexyl1oxo3(pyridin2yl)1234tetrahydroisoquinolin4yl)methyl)amino)ethylidene)1(4methylphenyl)pyrimidine246(1H3H5H)trione
CCCCCCN1C(=O)c2ccccc2C(C1c1ccccn1)CNC(=C1C(=O)NC(=O)N(C1=O)c1ccc(cc1)C)C
MFCD30714099
ZINC000575443634
ZINC000575443638

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Available files

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