Vitas-M small molecule compound
(5E)-1-benzyl-5-(1-{[2-(morpholin-4-ium-4-yl)ethyl]amino}propylidene)-2,6-dioxo-1,2,5,6-tetrahydropyrimidin-4-olate
Catalog ID
STL048001
SMILES CC/C(=C\1/C(=NC(=O)N(C1=O)Cc1ccccc1)[O-])/NCC[NH+]1CCOCC1
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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 C20H26N4O4 MW 386.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26N4O4/c1-2-16(21-8-9-23-10-12-28-13-11-23)17-18(25)22-20(27)24(19(17)26)14-15-6-4-3-5-7-15/h3-7,21H,2,8-14H2,1H3,(H,22,25,27)/b17-16+InChIKey
JSPXXAMBQKFHQE-WUKNDPDISA-NSynonyms
(5E)1benzyl5(1((2(morpholin4ium4yl)ethyl)amino)propylidene)26dioxo1256tetrahydropyrimidin4olate
(5E)1benzyl5(1(2morpholin4ium4ylethylamino)propylidene)46dioxopyrimidin2olate
(5E)1BENZYL5(1(2MORPHOLIN4YLETHYLAMINO)PROPYLIDENE)13DIAZINANE246TRIONE
CCC(=C1C(=NC(=O)N(C1=O)Cc1ccccc1)(O))NCC(NH+)1CCOCC1
CCC(=C1C(=O)N=C(N(C1=O)CC2=CC=CC=C2)(O))NCC(NH+)3CCOCC3
InChI=1SC20H26N4O4c1216(218923101228131123)1718(25)2220(27)24(19(17)26)14156435715h3721H2814H21H3(H222527)b1716+
MFCD18249165
ZINC000019363689
ZINC19363689
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