Vitas-M small molecule compound
8-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-1,3-dimethyl-3,9-dihydro-1H-purine-2,6-dione
Catalog ID
STK065953
SMILES Clc1ccc(cc1)C(=O)CSc1nc2c([nH]1)n(C)c(=O)n(c2=O)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 C15H13ClN4O3S MW 364.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13ClN4O3S/c1-19-12-11(13(22)20(2)15(19)23)17-14(18-12)24-7-10(21)8-3-5-9(16)6-4-8/h3-6H,7H2,1-2H3,(H,17,18)InChIKey
NXIMWDAOBDJQRW-UHFFFAOYSA-NSynonyms
8((2(4CHLOROPHENYL)2OXOETHYL)SULFANYL)13DIMETHYL37DIHYDRO1HPURINE26DIONE
8((2(4CHLOROPHENYL)2OXOETHYL)SULFANYL)13DIMETHYL39DIHYDRO1HPURINE26DIONE
8(2(4CHLOROPHENYL)2OXOETHYL)SULFANYL13DIMETHYL7HPURINE26DIONE
8(2(4CHLOROPHENYL)2OXOETHYLTHIO)13DIMETHYL13DIHYDROPURINE26DIONE
Clc1ccc(cc1)C(=O)CSc1nc2c((nH)1)n(C)c(=O)n(c2=O)C
CN1C2=C(C(=O)N(C1=O)C)NC(=N2)SCC(=O)C3=CC=C(C=C3)Cl
InChI=1SC15H13ClN4O3Sc1191211(13(22)20(2)15(19)23)1714(1812)24710(21)8359(16)648h36H7H212H3(H1718)
MFCD06405546
STK065953
ZINC000100970395
ZINC100970395
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