Vitas-M small molecule compound
N-cyclohexyl-2-{[5-{[(4,6-diaminopyrimidin-2-yl)sulfanyl]methyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STL079529
SMILES C=CCn1c(SCC(=O)NC2CCCCC2)nnc1CSc1nc(N)cc(n1)N
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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 C18H26N8OS2 MW 434.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H26N8OS2/c1-2-8-26-15(10-28-17-22-13(19)9-14(20)23-17)24-25-18(26)29-11-16(27)21-12-6-4-3-5-7-12/h2,9,12H,1,3-8,10-11H2,(H,21,27)(H4,19,20,22,23)InChIKey
FKIICHHCTJFZBJ-UHFFFAOYSA-NSynonyms
2(5((46DIAMINOPYRIMIDIN2YLTHIO)METHYL)4PROP2ENYL(124TRIAZOL3YLTHIO))NCYCLOHEXYLACETAMIDE
C=CCN1C(=NN=C1SCC(=O)NC2CCCCC2)CSC3=NC(=CC(=N3)N)N
InChI=1SC18H26N8OS2c1282615(1028172213(19)914(20)2317)242518(26)291116(27)21126435712h2912H1381011H2(H2127)(H419202223)
MFCD05885132
Ncyclohexyl2((5(((46diaminopyrimidin2yl)sulfanyl)methyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)acetamide
NCYCLOHEXYL2((5((46DIAMINOPYRIMIDIN2YL)SULFANYLMETHYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000006147831
ZINC06147831
ZINC6147831
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