Vitas-M small molecule compound

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

Catalog ID
STK054562
SMILES CCn1c(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 C17H20N4O2S MW 344.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N4O2S/c1-3-21-13-14(20(2)16(23)19-15(13)22)18-17(21)24-11-7-10-12-8-5-4-6-9-12/h4-6,8-9H,3,7,10-11H2,1-2H3,(H,19,22,23)
InChIKey
GTNOWERGPMKZKY-UHFFFAOYSA-N
Synonyms
303970-84-5
303970845
7ETHYL3METHYL8((3PHENYLPROPYL)SULFANYL)37DIHYDRO1HPURINE26DIONE
7ethyl3methyl8((3phenylpropyl)thio)1Hpurine26(3H7H)dione
7ETHYL3METHYL8(3PHENYLPROPYLSULFANYL)37DIHYDROPURINE26DIONE
7ETHYL3METHYL8(3PHENYLPROPYLSULFANYL)PURINE26DIONE
7ETHYL3METHYL8(3PHENYLPROPYLTHIO)137TRIHYDROPURINE26DIONE
CCn1c(SCCCc2ccccc2)nc2c1c(=O)(nH)c(=O)n2C
CCN1C2=C(N=C1SCCCC3=CC=CC=C3)N(C(=O)NC2=O)C
InChI=1SC17H20N4O2Sc13211314(20(2)16(23)1915(13)22)1817(21)2411710128546912h4689H371011H212H3(H192223)
MFCD01185883
STK054562
ZINC000013512808
ZINC13512808

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Available files

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