Vitas-M small molecule compound
7-[2-(1H-benzimidazol-2-ylsulfanyl)ethyl]-1,3-dimethyl-8-(pyrrolidin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STL340430
SMILES Cn1c(=O)n(C)c2c(c1=O)n(CCSc1nc3c([nH]1)cccc3)c(n2)N1CCCC1
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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 C20H23N7O2S MW 425.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N7O2S/c1-24-16-15(17(28)25(2)20(24)29)27(19(23-16)26-9-5-6-10-26)11-12-30-18-21-13-7-3-4-8-14(13)22-18/h3-4,7-8H,5-6,9-12H2,1-2H3,(H,21,22)InChIKey
NGGNGATYALLBCX-UHFFFAOYSA-NSynonyms
476482-54-9476482549
7(2((1HBENZO(D)IMIDAZOL2YL)THIO)ETHYL)13DIMETHYL8(PYRROLIDIN1YL)1HPURINE26(3H7H)DIONE
7(2(1Hbenzimidazol2ylsulfanyl)ethyl)13dimethyl8(pyrrolidin1yl)37dihydro1Hpurine26dione
7(2(1HBENZIMIDAZOL2YLSULFANYL)ETHYL)13DIMETHYL8PYRROLIDIN1YLPURINE26DIONE
7(2(1HBENZOIMIDAZOL2YLSULFANYL)ETHYL)13DIMETHYL8PYRROLIDIN1YL37DIHYDROPURINE26DIONE
7(2BENZIMIDAZOL2YLTHIOETHYL)13DIMETHYL8PYRROLIDINYL137TRIHYDROPURINE26DIONE
Cn1c(=O)n(C)c2c(c1=O)n(CCSc1nc3c((nH)1)cccc3)c(n2)N1CCCC1
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCCC3)CCSC4=NC5=CC=CC=C5N4
InChI=1SC20H23N7O2Sc1241615(17(28)25(2)20(24)29)27(19(2316)269561026)111230182113734814(13)2218h3478H56912H212H3(H2122)
MFCD03933823
ZINC000000808381
ZINC00808381
ZINC808381
Check stock
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Check stock on Vitas-MAvailable files
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