Vitas-M small molecule compound
(5E)-1-benzyl-5-(1-{[3-(dimethylammonio)propyl]amino}ethylidene)-2,6-dioxo-1,2,5,6-tetrahydropyrimidin-4-olate
Catalog ID
STL055595
SMILES C[NH+](CCCN/C(=C/1\C(=NC(=O)N(C1=O)Cc1ccccc1)[O-])/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 C18H24N4O3 MW 344.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H24N4O3/c1-13(19-10-7-11-21(2)3)15-16(23)20-18(25)22(17(15)24)12-14-8-5-4-6-9-14/h4-6,8-9,19H,7,10-12H2,1-3H3,(H,20,23,25)/b15-13+InChIKey
PAGIXXBVAKNBOG-FYWRMAATSA-NSynonyms
(5E)1benzyl5(1((3(dimethylammonio)propyl)amino)ethylidene)26dioxo1256tetrahydropyrimidin4olate
(5E)1BENZYL5(1(3(DIMETHYLAMINO)PROPYLAMINO)ETHYLIDENE)13DIAZINANE246TRIONE
(5E)1BENZYL5(1(3(DIMETHYLAZANIUMYL)PROPYLAMINO)ETHYLIDENE)46DIOXOPYRIMIDIN2OLATE
C(NH+)(CCCNC(=C1C(=NC(=O)N(C1=O)Cc1ccccc1)(O))C)C
CC(=C1C(=O)NC(=O)N(C1=O)CC2=CC=CC=C2)NCCCN(C)C
InChI=1SC18H24N4O3c113(191071121(2)3)1516(23)2018(25)22(17(15)24)12148546914h468919H71012H213H3(H202325)b1513+
MFCD18249688
ZINC000020292253
ZINC20292253
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