Vitas-M small molecule compound

1,3-dimethyl-8-[(4-methylbenzyl)sulfanyl]-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK840871
SMILES Cc1ccc(cc1)CSc1nc2c(n1CCCc1ccccc1)c(=O)n(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 C24H26N4O2S MW 434.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26N4O2S/c1-17-11-13-19(14-12-17)16-31-23-25-21-20(22(29)27(3)24(30)26(21)2)28(23)15-7-10-18-8-5-4-6-9-18/h4-6,8-9,11-14H,7,10,15-16H2,1-3H3
InChIKey
UMFZEJUSGZNWDB-UHFFFAOYSA-N
Synonyms
377061-09-1
13dimethyl8((4methylbenzyl)sulfanyl)7(3phenylpropyl)37dihydro1Hpurine26dione
13dimethyl8((4methylbenzyl)thio)7(3phenylpropyl)1Hpurine26(3H7H)dione
13DIMETHYL8((4METHYLPHENYL)METHYLSULFANYL)7(3PHENYLPROPYL)PURINE26DIONE
13DIMETHYL8((4METHYLPHENYL)METHYLTHIO)7(3PHENYLPROPYL)137TRIHYDROPURINE26DIONE
377061091
CC1=CC=C(C=C1)CSC2=NC3=C(N2CCCC4=CC=CC=C4)C(=O)N(C(=O)N3C)C
InChI=1SC24H26N4O2Sc117111319(141217)163123252120(22(29)27(3)24(30)26(21)2)28(23)15710188546918h46891114H7101516H213H3
MFCD02982835
ZINC000000637429
ZINC00637429
ZINC637429

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Available files

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