Vitas-M small molecule compound

3-methyl-7-(3-methylbenzyl)-8-(nonylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK700791
SMILES CCCCCCCCCSc1nc2c(n1Cc1cccc(c1)C)c(=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 C23H32N4O2S MW 428.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H32N4O2S/c1-4-5-6-7-8-9-10-14-30-23-24-20-19(21(28)25-22(29)26(20)3)27(23)16-18-13-11-12-17(2)15-18/h11-13,15H,4-10,14,16H2,1-3H3,(H,25,28,29)
InChIKey
CWXXSXSKGKICTR-UHFFFAOYSA-N
Synonyms
303973-34-4
303973344
3METHYL7((3METHYLPHENYL)METHYL)8NONYLSULFANYLPURINE26DIONE
3METHYL7((3METHYLPHENYL)METHYL)8NONYLTHIO137TRIHYDROPURINE26DIONE
3methyl7(3methylbenzyl)8(nonylsulfanyl)37dihydro1Hpurine26dione
3methyl7(3methylbenzyl)8(nonylthio)1Hpurine26(3H7H)dione
3METHYL7(3METHYLBENZYL)8NONYLSULFANYL37DIHYDROPURINE26DIONE
CCCCCCCCCSC1=NC2=C(N1CC3=CC=CC(=C3)C)C(=O)NC(=O)N2C
CCCCCCCCCSc1nc2c(n1Cc1cccc(c1)C)c(=O)(nH)c(=O)n2C
InChI=1SC23H32N4O2Sc145678910143023242019(21(28)2522(29)26(20)3)27(23)161813111217(2)1518h111315H4101416H213H3(H252829)
MFCD01186387
ZINC000002300501
ZINC2300501

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Available files

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