Vitas-M small molecule compound
1,3,7-trimethyl-8-({1-[2-(morpholin-4-yl)-2-oxoethyl]-1H-benzimidazol-2-yl}sulfanyl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK764144
SMILES O=C(N1CCOCC1)Cn1c(nc2c1cccc2)Sc1nc2c(n1C)c(=O)n(c(=O)n2C)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 C21H23N7O4S MW 469.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N7O4S/c1-24-16-17(25(2)21(31)26(3)18(16)30)23-19(24)33-20-22-13-6-4-5-7-14(13)28(20)12-15(29)27-8-10-32-11-9-27/h4-7H,8-12H2,1-3H3InChIKey
SOJGVZBBNNGDOX-UHFFFAOYSA-NSynonyms
137trimethyl8((1(2(morpholin4yl)2oxoethyl)1Hbenzimidazol2yl)sulfanyl)37dihydro1Hpurine26dione
137TRIMETHYL8(1(2MORPHOLIN4YL2OXOETHYL)BENZIMIDAZOL2YL)SULFANYLPURINE26DIONE
137TRIMETHYL8(1(2MORPHOLIN4YL2OXOETHYL)BENZIMIDAZOL2YLTHIO)137TRIHYDROPURINE26DIONE
CN1C2=C(N=C1SC3=NC4=CC=CC=C4N3CC(=O)N5CCOCC5)N(C(=O)N(C2=O)C)C
InChI=1SC21H23N7O4Sc1241617(25(2)21(31)26(3)18(16)30)2319(24)33202213645714(13)28(20)1215(29)278103211927h47H812H213H3
MFCD02324846
ZINC000001026985
ZINC01026985
ZINC1026985
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