Vitas-M small molecule compound

3-methyl-7-(4-methylbenzyl)-8-[(3-phenylpropyl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK839896
SMILES Cc1ccc(cc1)Cn1c(SCCCc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C

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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 C23H24N4O2S MW 420.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N4O2S/c1-16-10-12-18(13-11-16)15-27-19-20(26(2)22(29)25-21(19)28)24-23(27)30-14-6-9-17-7-4-3-5-8-17/h3-5,7-8,10-13H,6,9,14-15H2,1-2H3,(H,25,28,29)
InChIKey
KQLYAXCGODRZBD-UHFFFAOYSA-N
Synonyms
332103-39-6
332103396
3METHYL7((4METHYLPHENYL)METHYL)8(3PHENYLPROPYLSULFANYL)PURINE26DIONE
3METHYL7((4METHYLPHENYL)METHYL)8(3PHENYLPROPYLTHIO)137TRIHYDROPURINE26DIONE
3methyl7(4methylbenzyl)8((3phenylpropyl)sulfanyl)37dihydro1Hpurine26dione
3METHYL7(4METHYLBENZYL)8((3PHENYLPROPYL)THIO)1HPURINE26(3H7H)DIONE
CC1=CC=C(C=C1)CN2C3=C(N=C2SCCCC4=CC=CC=C4)N(C(=O)NC3=O)C
Cc1ccc(cc1)Cn1c(SCCCc2ccccc2)nc2c1c(=O)(nH)c(=O)n2C
InChI=1SC23H24N4O2Sc116101218(131116)15271920(26(2)22(29)2521(19)28)2423(27)301469177435817h35781013H691415H212H3(H252829)
MFCD01875232
ZINC000002063828
ZINC02063828
ZINC2063828

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Available files

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