Vitas-M small molecule compound

7-heptyl-8-(hexylsulfanyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK096020
SMILES CCCCCCSc1nc2c(n1CCCCCCC)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 C19H32N4O2S MW 380.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H32N4O2S/c1-4-6-8-10-11-13-23-15-16(22(3)18(25)21-17(15)24)20-19(23)26-14-12-9-7-5-2/h4-14H2,1-3H3,(H,21,24,25)
InChIKey
XXLYORWUXMOKKU-UHFFFAOYSA-N
Synonyms
303969-09-7
303969097
7HEPTYL8(HEXYLSULFANYL)3METHYL37DIHYDRO1HPURINE26DIONE
7HEPTYL8(HEXYLSULFANYL)6HYDROXY3METHYL37DIHYDRO2HPURIN2ONE
7heptyl8(hexylthio)3methyl1Hpurine26(3H7H)dione
7HEPTYL8HEXYLSULFANYL3METHYL37DIHYDROPURINE26DIONE
7HEPTYL8HEXYLSULFANYL3METHYLPURINE26DIONE
7HEPTYL8HEXYLTHIO3METHYL137TRIHYDROPURINE26DIONE
CCCCCCCN1C2=C(N=C1SCCCCCC)N(C(=O)NC2=O)C
CCCCCCSc1nc2c(n1CCCCCCC)c(=O)(nH)c(=O)n2C
InChI=1SC19H32N4O2Sc1468101113231516(22(3)18(25)2117(15)24)2019(23)2614129752h414H213H3(H212425)
MFCD01185918
STK096020
ZINC53290205

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Available files

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