Vitas-M small molecule compound
3-methyl-7-(3-methylbutyl)-8-[(3-phenylpropyl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK700302
SMILES CC(CCn1c(SCCCc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C)C
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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 C20H26N4O2S MW 386.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26N4O2S/c1-14(2)11-12-24-16-17(23(3)19(26)22-18(16)25)21-20(24)27-13-7-10-15-8-5-4-6-9-15/h4-6,8-9,14H,7,10-13H2,1-3H3,(H,22,25,26)InChIKey
TVLRXKXANCSNIF-UHFFFAOYSA-NSynonyms
331842-92-3331842923
3methyl7(3methylbutyl)8((3phenylpropyl)sulfanyl)37dihydro1Hpurine26dione
3METHYL7(3METHYLBUTYL)8(3PHENYLPROPYLSULFANYL)PURINE26DIONE
3METHYL7(3METHYLBUTYL)8(3PHENYLPROPYLTHIO)137TRIHYDROPURINE26DIONE
7isopentyl3methyl8((3phenylpropyl)thio)1Hpurine26(3H7H)dione
CC(C)CCN1C2=C(N=C1SCCCC3=CC=CC=C3)N(C(=O)NC2=O)C
CC(CCn1c(SCCCc2ccccc2)nc2c1c(=O)(nH)c(=O)n2C)C
InChI=1SC20H26N4O2Sc114(2)1112241617(23(3)19(26)2218(16)25)2120(24)2713710158546915h468914H71013H213H3(H222526)
MFCD01051792
ZINC000012532273
ZINC12532273
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