Vitas-M small molecule compound
7-[2-(1,3-benzothiazol-2-ylsulfanyl)ethyl]-8-bromo-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STL336993
SMILES Cn1c(=O)n(C)c2c(c1=O)n(CCSc1nc3c(s1)cccc3)c(n2)Br
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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 C16H14BrN5O2S2 MW 452.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14BrN5O2S2/c1-20-12-11(13(23)21(2)16(20)24)22(14(17)19-12)7-8-25-15-18-9-5-3-4-6-10(9)26-15/h3-6H,7-8H2,1-2H3InChIKey
ZFSUVSHTEIIOHK-UHFFFAOYSA-NSynonyms
476482-01-6476482016
7(2(13benzothiazol2ylsulfanyl)ethyl)8bromo13dimethyl37dihydro1Hpurine26dione
7(2(13BENZOTHIAZOL2YLSULFANYL)ETHYL)8BROMO13DIMETHYLPURINE26DIONE
7(2(BENZO(D)THIAZOL2YLTHIO)ETHYL)8BROMO13DIMETHYL1HPURINE26(3H7H)DIONE
7(2BENZOTHIAZOL2YLTHIOETHYL)8BROMO13DIMETHYL137TRIHYDROPURINE26DIONE
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)Br)CCSC3=NC4=CC=CC=C4S3
InChI=1SC16H14BrN5O2S2c1201211(13(23)21(2)16(20)24)22(14(17)1912)782515189534610(9)2615h36H78H212H3
MFCD03670054
ZINC000001245586
ZINC01245586
ZINC1245586
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