Vitas-M small molecule compound

2-[(5-butyl-4,6-dihydroxypyrimidin-2-yl)sulfanyl]-N,N-diethylethanaminium

Catalog ID
STL037406
SMILES CCCCc1c(O)nc(nc1O)SCC[NH+](CC)CC

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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 C14H26N3O2S MW 300.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H25N3O2S/c1-4-7-8-11-12(18)15-14(16-13(11)19)20-10-9-17(5-2)6-3/h4-10H2,1-3H3,(H2,15,16,18,19)/p+1
InChIKey
ANKAWBHFPTWOMW-UHFFFAOYSA-O
Synonyms

2((5butyl46dihydroxypyrimidin2yl)sulfanyl)NNdiethylethanaminium
2((5BUTYL4HYDROXY6OXO16DIHYDROPYRIMIDIN2YL)SULFANYL)NNDIETHYLETHANAMINIUM
2((5BUTYL4HYDROXY6OXO1HPYRIMIDIN2YL)SULFANYL)ETHYLDIETHYLAZANIUM
CCCCC1=C(N=C(NC1=O)SCC(NH+)(CC)CC)O
CCCCc1c(O)nc(nc1O)SCC(NH+)(CC)CC
InChI=1SC14H25N3O2Sc14781112(18)1514(1613(11)19)2010917(52)63h410H213H3(H215161819)p+1
ZINC000013382309
ZINC09353061

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Available files

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