Vitas-M small molecule compound
8-(benzylsulfanyl)-1,3-dimethyl-7-(3-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK840456
SMILES Cc1cccc(c1)Cn1c(SCc2ccccc2)nc2c1c(=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 C22H22N4O2S MW 406.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4O2S/c1-15-8-7-11-17(12-15)13-26-18-19(24(2)22(28)25(3)20(18)27)23-21(26)29-14-16-9-5-4-6-10-16/h4-12H,13-14H2,1-3H3InChIKey
VVQQVBXMVHCTQK-UHFFFAOYSA-NSynonyms
378200-30-713DIMETHYL7((3METHYLPHENYL)METHYL)8(PHENYLMETHYLTHIO)137TRIHYDROPURINE26DIONE
378200307
8(benzylsulfanyl)13dimethyl7(3methylbenzyl)37dihydro1Hpurine26dione
8(BENZYLTHIO)13DIMETHYL7(3METHYLBENZYL)1HPURINE26(3H7H)DIONE
8BENZYLSULFANYL13DIMETHYL7((3METHYLPHENYL)METHYL)PURINE26DIONE
CC1=CC(=CC=C1)CN2C3=C(N=C2SCC4=CC=CC=C4)N(C(=O)N(C3=O)C)C
InChI=1SC22H22N4O2Sc115871117(1215)13261819(24(2)22(28)25(3)20(18)27)2321(26)29141695461016h412H1314H213H3
MFCD02984134
ZINC000000637743
ZINC00637743
ZINC637743
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