Vitas-M small molecule compound
8-(benzylsulfanyl)-3-methyl-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK834301
SMILES Cn1c(=O)[nH]c(=O)c2c1nc(n2CCCc1ccccc1)SCc1ccccc1
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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 C22H22N4O2S MW 406.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4O2S/c1-25-19-18(20(27)24-21(25)28)26(14-8-13-16-9-4-2-5-10-16)22(23-19)29-15-17-11-6-3-7-12-17/h2-7,9-12H,8,13-15H2,1H3,(H,24,27,28)InChIKey
BQOKAJYLHXGYAV-UHFFFAOYSA-NSynonyms
328069-72-3328069723
3METHYL8(PHENYLMETHYLTHIO)7(3PHENYLPROPYL)137TRIHYDROPURINE26DIONE
8(benzylsulfanyl)3methyl7(3phenylpropyl)37dihydro1Hpurine26dione
8(benzylthio)3methyl7(3phenylpropyl)1Hpurine26(3H7H)dione
8BENZYLSULFANYL3METHYL7(3PHENYLPROPYL)37DIHYDROPURINE26DIONE
8BENZYLSULFANYL3METHYL7(3PHENYLPROPYL)PURINE26DIONE
Cn1c(=O)(nH)c(=O)c2c1nc(n2CCCc1ccccc1)SCc1ccccc1
CN1C2=C(C(=O)NC1=O)N(C(=N2)SCC3=CC=CC=C3)CCCC4=CC=CC=C4
InChI=1SC22H22N4O2Sc1251918(20(27)2421(25)28)26(148131694251016)22(2319)291517116371217h27912H81315H21H3(H242728)
MFCD01032179
ZINC000000842290
ZINC00842290
ZINC842290
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