Vitas-M small molecule compound
(2E)-1-[5-amino-3-(methylsulfanyl)-1H-1,2,4-triazol-1-yl]-2-(2-hydroxyethyl)-3-{[3-(methylsulfanyl)-1H-1,2,4-triazol-5-yl]amino}but-2-en-1-one
Catalog ID
STK263503
SMILES OCC/C(=C(\Nc1[nH]nc(n1)SC)/C)/C(=O)n1nc(nc1N)SC
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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 C12H18N8O2S2 MW 370.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H18N8O2S2/c1-6(14-10-16-11(23-2)18-17-10)7(4-5-21)8(22)20-9(13)15-12(19-20)24-3/h21H,4-5H2,1-3H3,(H2,13,15,19)(H2,14,16,17,18)/b7-6+InChIKey
JTLKAQSYIOVHNZ-VOTSOKGWSA-NSynonyms
(2E)1(5amino3(methylsulfanyl)1H124triazol1yl)2(2hydroxyethyl)3((3(methylsulfanyl)1H124triazol5yl)amino)but2en1one
(2E)1(5AMINO3METHYLTHIO(124TRIAZOLYL))2(2HYDROXYETHYL)3((3METHYLTHIO(1H124TRIAZOL5YL))AMINO)BUT2EN1ONE
(E)1(5amino3methylsulfanyl124triazol1yl)2(2hydroxyethyl)3((3methylsulfanyl1H124triazol5yl)amino)but2en1one
(Z)1(5amino3(methylthio)1H124triazol1yl)2(2hydroxyethyl)3((3(methylthio)1H124triazol5yl)amino)but2en1one
CC(=C(CCO)C(=O)N1C(=NC(=N1)SC)N)NC2=NC(=NN2)SC
InChI=1SC12H18N8O2S2c16(14101611(232)181710)7(4521)8(22)209(13)1512(1920)243h21H45H213H3(H2131519)(H214161718)b76+
MFCD08547448
OCCC(=C(Nc1(nH)nc(n1)SC)C)C(=O)n1nc(nc1N)SC
ZINC000100135241
ZINC100135241
Check stock
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