Vitas-M small molecule compound

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

Catalog ID
STK081400
SMILES CCCCCCCCCCn1c(SCCCCCCC)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 C23H40N4O2S MW 436.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H40N4O2S/c1-4-6-8-10-11-12-13-15-17-27-19-20(26(3)22(29)25-21(19)28)24-23(27)30-18-16-14-9-7-5-2/h4-18H2,1-3H3,(H,25,28,29)
InChIKey
JXQPPCVBOZTTGA-UHFFFAOYSA-N
Synonyms
303969-29-1
7DECYL8(HEPTYLSULFANYL)3METHYL37DIHYDRO1HPURINE26DIONE
7DECYL8(HEPTYLSULFANYL)6HYDROXY3METHYL37DIHYDRO2HPURIN2ONE
7decyl8(heptylthio)3methyl1Hpurine26(3H7H)dione
7DECYL8HEPTYLSULFANYL3METHYL37DIHYDROPURINE26DIONE
7DECYL8HEPTYLSULFANYL3METHYLPURINE26DIONE
CCCCCCCCCCn1c(SCCCCCCC)nc2c1c(=O)(nH)c(=O)n2C
CCCCCCCCCCN1C2=C(N=C1SCCCCCCC)N(C(=O)NC2=O)C
InChI=1SC23H40N4O2Sc1468101112131517271920(26(3)22(29)2521(19)28)2423(27)301816149752h418H213H3(H252829)
MFCD01185951
STK081400
ZINC000008426364
ZINC08426364
ZINC8426364

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Available files

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