Vitas-M small molecule compound
7-(4-chlorobenzyl)-8-[(2-hydroxyethyl)sulfanyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK079794
SMILES OCCSc1nc2c(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 C16H17ClN4O3S MW 380.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17ClN4O3S/c1-19-13-12(14(23)20(2)16(19)24)21(15(18-13)25-8-7-22)9-10-3-5-11(17)6-4-10/h3-6,22H,7-9H2,1-2H3InChIKey
BQWNOBHGIQSFCM-UHFFFAOYSA-NSynonyms
303971-17-7303971177
7((4CHLOROPHENYL)METHYL)8(2HYDROXYETHYLSULFANYL)13DIMETHYLPURINE26DIONE
7(4CHLOROBENZYL)8((2HYDROXYETHYL)SULFANYL)13DIMETHYL37DIHYDRO1HPURINE26DIONE
7(4CHLOROBENZYL)8((2HYDROXYETHYL)THIO)13DIMETHYL1HPURINE26(3H7H)DIONE
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)SCCO)CC3=CC=C(C=C3)Cl
InChI=1SC16H17ClN4O3Sc1191312(14(23)20(2)16(19)24)21(15(1813)258722)9103511(17)6410h3622H79H212H3
MFCD01142823
OCCSc1nc2c(n1Cc1ccc(cc1)Cl)c(=O)n(c(=O)n2C)C
STK079794
ZINC000013512340
ZINC13512340
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