Vitas-M small molecule compound
7-[2-(1H-benzimidazol-2-ylsulfanyl)ethyl]-6-hydroxy-3-methyl-8-(piperidin-1-yl)-3,7-dihydro-2H-purin-2-one
Catalog ID
STK569838
SMILES Cn1c(=O)nc(c2c1nc(n2CCSc1nc2c([nH]1)cccc2)N1CCCCC1)O
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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/c1-25-16-15(17(28)24-20(25)29)27(19(23-16)26-9-5-2-6-10-26)11-12-30-18-21-13-7-3-4-8-14(13)22-18/h3-4,7-8H,2,5-6,9-12H2,1H3,(H,21,22)(H,24,28,29)InChIKey
PXVHOYWIFUXTHQ-UHFFFAOYSA-NSynonyms
476482-53-8476482538
7(2((1HBENZO(D)IMIDAZOL2YL)THIO)ETHYL)3METHYL8(PIPERIDIN1YL)1HPURINE26(3H7H)DIONE
7(2(1HBENZIMIDAZOL2YLSULFANYL)ETHYL)3METHYL8PIPERIDIN1YLPURINE26DIONE
7(2(1Hbenzimidazol2ylsulfanyl)ethyl)6hydroxy3methyl8(piperidin1yl)37dihydro2Hpurin2one
7(2BENZIMIDAZOL2YLTHIOETHYL)3METHYL8PIPERIDYL137TRIHYDROPURINE26DIONE
Cn1c(=O)nc(c2c1nc(n2CCSc1nc2c((nH)1)cccc2)N1CCCCC1)O
CN1C2=C(C(=O)NC1=O)N(C(=N2)N3CCCCC3)CCSC4=NC5=CC=CC=C5N4
InChI=1SC20H23N7O2Sc1251615(17(28)2420(25)29)27(19(2316)2695261026)111230182113734814(13)2218h3478H256912H21H3(H2122)(H242829)
MFCD05733765
ZINC000000796604
ZINC00796604
ZINC796604
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