Vitas-M small molecule compound
8-[(4-chlorobutyl)sulfanyl]-3-methyl-7-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK062349
SMILES ClCCCCSc1nc2c(n1CCc1ccccc1)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 C18H21ClN4O2S MW 392.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21ClN4O2S/c1-22-15-14(16(24)21-17(22)25)23(11-9-13-7-3-2-4-8-13)18(20-15)26-12-6-5-10-19/h2-4,7-8H,5-6,9-12H2,1H3,(H,21,24,25)InChIKey
VAPLSLMMCSGCSD-UHFFFAOYSA-NSynonyms
332149-75-4332149754
8((4CHLOROBUTYL)SULFANYL)3METHYL7(2PHENYLETHYL)37DIHYDRO1HPURINE26DIONE
8((4chlorobutyl)thio)3methyl7phenethyl1Hpurine26(3H7H)dione
8(4chlorobutylsulfanyl)3methyl7(2phenylethyl)purine26dione
8(4CHLOROBUTYLSULFANYL)3METHYL7PHENETHYLPURINE26DIONE
ClCCCCSc1nc2c(n1CCc1ccccc1)c(=O)(nH)c(=O)n2C
CN1C2=C(C(=O)NC1=O)N(C(=N2)SCCCCCl)CCC3=CC=CC=C3
InChI=1SC18H21ClN4O2Sc1221514(16(24)2117(22)25)23(119137324813)18(2015)2612651019h2478H56912H21H3(H212425)
MFCD01142778
STK062349
ZINC000002059601
ZINC02059601
ZINC2059601
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