Vitas-M small molecule compound
N-cyclohexyl-2-{5-[(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]-1H-1,2,4-triazol-1-yl}acetamide
Catalog ID
STK770893
SMILES O=C(Cn1ncnc1Sc1nc2c(n1C)c(=O)n(c(=O)n2C)C)NC1CCCCC1
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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 C18H24N8O3S MW 432.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H24N8O3S/c1-23-13-14(24(2)18(29)25(3)15(13)28)22-17(23)30-16-19-10-20-26(16)9-12(27)21-11-7-5-4-6-8-11/h10-11H,4-9H2,1-3H3,(H,21,27)InChIKey
AQUWOYGMKIVQGG-UHFFFAOYSA-NSynonyms
666210-49-7666210497
CN1C2=C(N=C1SC3=NC=NN3CC(=O)NC4CCCCC4)N(C(=O)N(C2=O)C)C
InChI=1SC18H24N8O3Sc1231314(24(2)18(29)25(3)15(13)28)2217(23)301619102026(16)912(27)21117546811h1011H49H213H3(H2127)
MFCD03681262
Ncyclohexyl2(5((137trimethyl26dioxo2367tetrahydro1Hpurin8yl)sulfanyl)1H124triazol1yl)acetamide
Ncyclohexyl2(5((137trimethyl26dioxo2367tetrahydro1Hpurin8yl)thio)1H124triazol1yl)acetamide
NCYCLOHEXYL2(5(137TRIMETHYL26DIOXOPURIN8YL)SULFANYL124TRIAZOL1YL)ACETAMIDE
ZINC000000679520
ZINC00679520
ZINC679520
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