Vitas-M small molecule compound
7-benzyl-8-(butan-2-ylsulfanyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK837773
SMILES CCC(Sc1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)C)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 C18H22N4O2S MW 358.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N4O2S/c1-5-12(2)25-17-19-15-14(16(23)21(4)18(24)20(15)3)22(17)11-13-9-7-6-8-10-13/h6-10,12H,5,11H2,1-4H3InChIKey
BTPDNNXNQCAUTM-UHFFFAOYSA-NSynonyms
374549-26-513DIMETHYL8(METHYLPROPYLTHIO)7BENZYL137TRIHYDROPURINE26DIONE
374549265
7benzyl8(butan2ylsulfanyl)13dimethyl37dihydro1Hpurine26dione
7benzyl8(secbutylthio)13dimethyl1Hpurine26(3H7H)dione
7BENZYL8BUTAN2YLSULFANYL13DIMETHYLPURINE26DIONE
7BENZYL8SECBUTYLSULFANYL13DIMETHYL37DIHYDROPURINE26DIONE
CCC(C)SC1=NC2=C(N1CC3=CC=CC=C3)C(=O)N(C(=O)N2C)C
InChI=1SC18H22N4O2Sc1512(2)2517191514(16(23)21(4)18(24)20(15)3)22(17)111397681013h61012H511H214H3
MFCD01956555
ZINC000000625665
ZINC000000625668
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