Vitas-M small molecule compound
1,3-dimethyl-8-(3-methylpiperidin-1-yl)-7-{2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethyl}-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK851006
SMILES CC1CCCN(C1)c1nc2c(n1CCSc1nnnn1c1ccccc1)c(=O)n(c(=O)n2C)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 C22H27N9O2S MW 481.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N9O2S/c1-15-8-7-11-29(14-15)20-23-18-17(19(32)28(3)22(33)27(18)2)30(20)12-13-34-21-24-25-26-31(21)16-9-5-4-6-10-16/h4-6,9-10,15H,7-8,11-14H2,1-3H3InChIKey
FTPKQUZYBTVXGI-UHFFFAOYSA-NSynonyms
850914-55-513dimethyl8(3methylpiperidin1yl)7(2((1phenyl1Htetrazol5yl)sulfanyl)ethyl)37dihydro1Hpurine26dione
13DIMETHYL8(3METHYLPIPERIDIN1YL)7(2((1PHENYL1HTETRAZOL5YL)THIO)ETHYL)1HPURINE26(3H7H)DIONE
13DIMETHYL8(3METHYLPIPERIDIN1YL)7(2(1PHENYLTETRAZOL5YL)SULFANYLETHYL)PURINE26DIONE
850914555
CC1CCCN(C1)C2=NC3=C(N2CCSC4=NN=NN4C5=CC=CC=C5)C(=O)N(C(=O)N3C)C
InChI=1SC22H27N9O2Sc115871129(1415)20231817(19(32)28(3)22(33)27(18)2)30(20)1213342124252631(21)1695461016h4691015H781114H213H3
MFCD04456927
ZINC000009157065
ZINC000009157066
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