Vitas-M small molecule compound
7-(4-chlorobenzyl)-1,3-dimethyl-8-[(2-oxopropyl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK867873
SMILES CC(=O)CSc1nc2c(n1Cc1ccc(cc1)Cl)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 C17H17ClN4O3S MW 392.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17ClN4O3S/c1-10(23)9-26-16-19-14-13(15(24)21(3)17(25)20(14)2)22(16)8-11-4-6-12(18)7-5-11/h4-7H,8-9H2,1-3H3InChIKey
KRDCEMKJWGJLMK-UHFFFAOYSA-NSynonyms
303971-25-7303971257
7((4CHLOROPHENYL)METHYL)13DIMETHYL8(2OXOPROPYLSULFANYL)PURINE26DIONE
7(4chlorobenzyl)13dimethyl8((2oxopropyl)sulfanyl)37dihydro1Hpurine26dione
7(4chlorobenzyl)13dimethyl8((2oxopropyl)thio)1Hpurine26(3H7H)dione
CC(=O)CSC1=NC2=C(N1CC3=CC=C(C=C3)Cl)C(=O)N(C(=O)N2C)C
InChI=1SC17H17ClN4O3Sc110(23)92616191413(15(24)21(3)17(25)20(14)2)22(16)8114612(18)7511h47H89H213H3
MFCD01142831
ZINC000000647519
ZINC00647519
ZINC647519
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