Vitas-M small molecule compound

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

Catalog ID
STK527155
SMILES Cn1c(=O)[nH]c(=O)c2c1nc(n2CCCc1ccccc1)SCCCc1ccccc1

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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 C24H26N4O2S MW 434.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26N4O2S/c1-27-21-20(22(29)26-23(27)30)28(16-8-14-18-10-4-2-5-11-18)24(25-21)31-17-9-15-19-12-6-3-7-13-19/h2-7,10-13H,8-9,14-17H2,1H3,(H,26,29,30)
InChIKey
YPQVRJJQPRKZKF-UHFFFAOYSA-N
Synonyms
370840-89-4
370840894
3methyl7(3phenylpropyl)8((3phenylpropyl)sulfanyl)37dihydro1Hpurine26dione
3methyl7(3phenylpropyl)8((3phenylpropyl)thio)1Hpurine26(3H7H)dione
3METHYL7(3PHENYLPROPYL)8(3PHENYLPROPYLSULFANYL)PURINE26DIONE
3METHYL7(3PHENYLPROPYL)8(3PHENYLPROPYLTHIO)137TRIHYDROPURINE26DIONE
Cn1c(=O)(nH)c(=O)c2c1nc(n2CCCc1ccccc1)SCCCc1ccccc1
CN1C2=C(C(=O)NC1=O)N(C(=N2)SCCCC3=CC=CC=C3)CCCC4=CC=CC=C4
InChI=1SC24H26N4O2Sc1272120(22(29)2623(27)30)28(1681418104251118)24(2521)311791519126371319h271013H891417H21H3(H262930)
MFCD01032183
ZINC000012373955
ZINC12373955

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Available files

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