Vitas-M small molecule compound
6-hydroxy-3-methyl-8-(3-methylpiperidin-1-yl)-7-{2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethyl}-3,7-dihydro-2H-purin-2-one
Catalog ID
STK587766
SMILES CC1CCCN(C1)c1nc2c(n1CCSc1nnnn1c1ccccc1)c(O)nc(=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 C21H25N9O2S MW 467.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N9O2S/c1-14-7-6-10-28(13-14)19-22-17-16(18(31)23-20(32)27(17)2)29(19)11-12-33-21-24-25-26-30(21)15-8-4-3-5-9-15/h3-5,8-9,14H,6-7,10-13H2,1-2H3,(H,23,31,32)InChIKey
IOOSLNVOCPDPFF-UHFFFAOYSA-NSynonyms
850914-20-43METHYL8(3METHYLPIPERIDIN1YL)7(2((1PHENYL1HTETRAZOL5YL)THIO)ETHYL)1HPURINE26(3H7H)DIONE
3METHYL8(3METHYLPIPERIDIN1YL)7(2(1PHENYLTETRAZOL5YL)SULFANYLETHYL)PURINE26DIONE
6hydroxy3methyl8(3methylpiperidin1yl)7(2((1phenyl1Htetrazol5yl)sulfanyl)ethyl)37dihydro2Hpurin2one
850914204
CC1CCCN(C1)C2=NC3=C(N2CCSC4=NN=NN4C5=CC=CC=C5)C(=O)NC(=O)N3C
InChI=1SC21H25N9O2Sc114761028(1314)19221716(18(31)2320(32)27(17)2)29(19)1112332124252630(21)158435915h358914H671013H212H3(H233132)
MFCD07197870
ZINC000009124452
ZINC000009124453
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