Vitas-M small molecule compound

7-decyl-3-methyl-8-(propan-2-ylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK066236
SMILES CCCCCCCCCCn1c(SC(C)C)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 C19H32N4O2S MW 380.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H32N4O2S/c1-5-6-7-8-9-10-11-12-13-23-15-16(20-19(23)26-14(2)3)22(4)18(25)21-17(15)24/h14H,5-13H2,1-4H3,(H,21,24,25)
InChIKey
VRPACYVXXWGMHA-UHFFFAOYSA-N
Synonyms
303969-36-0
303969360
7DECYL3METHYL8((1METHYLETHYL)SULFANYL)37DIHYDRO1HPURINE26DIONE
7DECYL3METHYL8(METHYLETHYLTHIO)137TRIHYDROPURINE26DIONE
7DECYL3METHYL8(PROPAN2YLSULFANYL)37DIHYDRO1HPURINE26DIONE
7DECYL3METHYL8PROPAN2YLSULFANYLPURINE26DIONE
7DECYL6HYDROXY3METHYL8(PROPAN2YLSULFANYL)37DIHYDRO2HPURIN2ONE
7decyl8(isopropylthio)3methyl1Hpurine26(3H7H)dione
7DECYL8ISOPROPYLSULFANYL3METHYL37DIHYDROPURINE26DIONE
CCCCCCCCCCn1c(SC(C)C)nc2c1c(=O)(nH)c(=O)n2C
CCCCCCCCCCN1C2=C(N=C1SC(C)C)N(C(=O)NC2=O)C
InChI=1SC19H32N4O2Sc15678910111213231516(2019(23)2614(2)3)22(4)18(25)2117(15)24h14H513H214H3(H212425)
MFCD01185942
STK066236
ZINC08426357
ZINC8426357

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.