Vitas-M small molecule compound
(5E)-1-(butan-2-yl)-5-({[2-(morpholin-4-ium-4-yl)ethyl]amino}methylidene)-4,6-dioxo-1,4,5,6-tetrahydropyrimidine-2-thiolate
Catalog ID
STK569474
SMILES CCC(N1C(=NC(=O)/C(=C\NCC[NH+]2CCOCC2)/C1=O)[S-])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 C15H24N4O3S MW 340.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H24N4O3S/c1-3-11(2)19-14(21)12(13(20)17-15(19)23)10-16-4-5-18-6-8-22-9-7-18/h10-11,16H,3-9H2,1-2H3,(H,17,20,23)/b12-10+InChIKey
GDPXQXNERIESAT-ZRDIBKRKSA-NSynonyms
(5E)1(butan2yl)5(((2(morpholin4ium4yl)ethyl)amino)methylidene)46dioxo1456tetrahydropyrimidine2thiolate
(5E)1BUTAN2YL5((2MORPHOLIN4IUM4YLETHYLAMINO)METHYLIDENE)6OXO2SULFANYLIDENEPYRIMIDIN4OLATE
(5E)1BUTAN2YL5((2MORPHOLIN4YLETHYLAMINO)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
1SECBUTYL5(1(2MORPHOLIN4YLETHYLAMINO)METH(E)YLIDENE)2THIOXODIHYDROPYRIMIDINE46DIONE
CCC(C)N1C(=O)C(=CNCC(NH+)2CCOCC2)C(=NC1=S)(O)
CCC(N1C(=NC(=O)C(=CNCC(NH+)2CCOCC2)C1=O)(S))C
InChI=1SC15H24N4O3Sc1311(2)1914(21)12(13(20)1715(19)23)1016451868229718h101116H39H212H3(H172023)b1210+
MFCD18245296
ZINC000020266423
ZINC000020266426
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