Vitas-M small molecule compound

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

Catalog ID
STK699692
SMILES CCCCCCCCCn1c(SCCc2ccccc2)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 C23H32N4O2S MW 428.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H32N4O2S/c1-3-4-5-6-7-8-12-16-27-19-20(26(2)22(29)25-21(19)28)24-23(27)30-17-15-18-13-10-9-11-14-18/h9-11,13-14H,3-8,12,15-17H2,1-2H3,(H,25,28,29)
InChIKey
AGHJQSRIRBQNQQ-UHFFFAOYSA-N
Synonyms
316360-98-2
316360982
3methyl7nonyl8((2phenylethyl)sulfanyl)37dihydro1Hpurine26dione
3methyl7nonyl8(2phenylethylsulfanyl)purine26dione
3METHYL7NONYL8(2PHENYLETHYLTHIO)137TRIHYDROPURINE26DIONE
3methyl7nonyl8(phenethylthio)1Hpurine26(3H7H)dione
3METHYL7NONYL8PHENETHYLSULFANYL37DIHYDROPURINE26DIONE
3METHYL7NONYL8PHENETHYLSULFANYLPURINE26DIONE
CCCCCCCCCn1c(SCCc2ccccc2)nc2c1c(=O)(nH)c(=O)n2C
CCCCCCCCCN1C2=C(N=C1SCCC3=CC=CC=C3)N(C(=O)NC2=O)C
InChI=1SC23H32N4O2Sc13456781216271920(26(2)22(29)2521(19)28)2423(27)3017151813109111418h9111314H38121517H212H3(H252829)
MFCD01051789
ZINC000008424646
ZINC08424646
ZINC8424646

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Available files

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