Vitas-M small molecule compound

1,3-dimethyl-8-(morpholin-4-yl)-7-{2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethyl}-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK850635
SMILES Cn1c(=O)n(C)c2c(c1=O)n(CCSc1nnnn1c1ccccc1)c(n2)N1CCOCC1

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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 C20H23N9O3S MW 469.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N9O3S/c1-25-16-15(17(30)26(2)20(25)31)28(18(21-16)27-8-11-32-12-9-27)10-13-33-19-22-23-24-29(19)14-6-4-3-5-7-14/h3-7H,8-13H2,1-2H3
InChIKey
UTSMUZHSCOBVOC-UHFFFAOYSA-N
Synonyms
685860-73-5
13dimethyl8(morpholin4yl)7(2((1phenyl1Htetrazol5yl)sulfanyl)ethyl)37dihydro1Hpurine26dione
13DIMETHYL8MORPHOLIN4YL7(2(1PHENYLTETRAZOL5YL)SULFANYLETHYL)PURINE26DIONE
13DIMETHYL8MORPHOLINO7(2((1PHENYL1HTETRAZOL5YL)THIO)ETHYL)1HPURINE26(3H7H)DIONE
685860735
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCOCC3)CCSC4=NN=NN4C5=CC=CC=C5
InChI=1SC20H23N9O3Sc1251615(17(30)26(2)20(25)31)28(18(2116)278113212927)1013331922232429(19)146435714h37H813H212H3
MFCD04186841
ZINC000009243124
ZINC09243124
ZINC9243124

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Available files

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