Vitas-M small molecule compound

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

Catalog ID
STK833981
SMILES Cc1cccc(c1)Cn1c(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 C23H24N4O2S MW 420.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N4O2S/c1-16-8-6-11-18(14-16)15-27-19-20(26(2)22(29)25-21(19)28)24-23(27)30-13-7-12-17-9-4-3-5-10-17/h3-6,8-11,14H,7,12-13,15H2,1-2H3,(H,25,28,29)
InChIKey
ZYWGCAJUGWWAJW-UHFFFAOYSA-N
Synonyms
303973-14-0
303973140
3METHYL7((3METHYLPHENYL)METHYL)8(3PHENYLPROPYLSULFANYL)PURINE26DIONE
3METHYL7((3METHYLPHENYL)METHYL)8(3PHENYLPROPYLTHIO)137TRIHYDROPURINE26DIONE
3methyl7(3methylbenzyl)8((3phenylpropyl)sulfanyl)37dihydro1Hpurine26dione
3methyl7(3methylbenzyl)8((3phenylpropyl)thio)1Hpurine26(3H7H)dione
CC1=CC(=CC=C1)CN2C3=C(N=C2SCCCC4=CC=CC=C4)N(C(=O)NC3=O)C
Cc1cccc(c1)Cn1c(SCCCc2ccccc2)nc2c1c(=O)(nH)c(=O)n2C
InChI=1SC23H24N4O2Sc116861118(1416)15271920(26(2)22(29)2521(19)28)2423(27)30137121794351017h3681114H7121315H212H3(H252829)
MFCD01186404
ZINC000002060838
ZINC02060838
ZINC2060838

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Available files

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