Vitas-M small molecule compound
7-(4-chlorobenzyl)-3-methyl-8-[(2-oxopropyl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK034058
SMILES CC(=O)CSc1nc2c(n1Cc1ccc(cc1)Cl)c(=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 C16H15ClN4O3S MW 378.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15ClN4O3S/c1-9(22)8-25-16-18-13-12(14(23)19-15(24)20(13)2)21(16)7-10-3-5-11(17)6-4-10/h3-6H,7-8H2,1-2H3,(H,19,23,24)InChIKey
HHPXZOYBRXOSRX-UHFFFAOYSA-NSynonyms
313380-55-1313380551
7((4CHLOROPHENYL)METHYL)3METHYL8(2OXOPROPYLSULFANYL)PURINE26DIONE
7(4CHLOROBENZYL)3METHYL8((2OXOPROPYL)SULFANYL)37DIHYDRO1HPURINE26DIONE
7(4CHLOROBENZYL)3METHYL8((2OXOPROPYL)THIO)1HPURINE26(3H7H)DIONE
CC(=O)CSC1=NC2=C(N1CC3=CC=C(C=C3)Cl)C(=O)NC(=O)N2C
CC(=O)CSc1nc2c(n1Cc1ccc(cc1)Cl)c(=O)(nH)c(=O)n2C
InChI=1SC16H15ClN4O3Sc19(22)82516181312(14(23)1915(24)20(13)2)21(16)7103511(17)6410h36H78H212H3(H192324)
MFCD01051155
STK034058
ZINC000000728200
ZINC00728200
ZINC728200
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