Vitas-M small molecule compound
8-[benzyl(methyl)amino]-1,3-dimethyl-7-{2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethyl}-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK851069
SMILES O=c1n(C)c(=O)c2c(n1C)nc(n2CCSc1nnnn1c1ccccc1)N(Cc1ccccc1)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 C24H25N9O2S MW 503.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N9O2S/c1-29(16-17-10-6-4-7-11-17)22-25-20-19(21(34)31(3)24(35)30(20)2)32(22)14-15-36-23-26-27-28-33(23)18-12-8-5-9-13-18/h4-13H,14-16H2,1-3H3InChIKey
GUPMXEGPSSHUOO-UHFFFAOYSA-NSynonyms
850914-97-58(benzyl(methyl)amino)13dimethyl7(2((1phenyl1Htetrazol5yl)sulfanyl)ethyl)37dihydro1Hpurine26dione
8(BENZYL(METHYL)AMINO)13DIMETHYL7(2((1PHENYL1HTETRAZOL5YL)THIO)ETHYL)1HPURINE26(3H7H)DIONE
8(BENZYL(METHYL)AMINO)13DIMETHYL7(2(1PHENYLTETRAZOL5YL)SULFANYLETHYL)PURINE26DIONE
850914975
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N(C)CC3=CC=CC=C3)CCSC4=NN=NN4C5=CC=CC=C5
InChI=1SC24H25N9O2Sc129(1617106471117)22252019(21(34)31(3)24(35)30(20)2)32(22)1415362326272833(23)18128591318h413H1416H213H3
MFCD04456971
ZINC000009124018
ZINC09124018
ZINC9124018
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