Vitas-M small molecule compound

1,3-dimethyl-8-(piperidin-1-yl)-7-{3-[(2E)-piperidin-2-ylideneamino]propyl}-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK677799
SMILES Cn1c(=O)n(C)c2c(c1=O)n(CCC/N=C/1\CCCCN1)c(n2)N1CCCCC1

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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 C20H31N7O2 MW 401.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H31N7O2/c1-24-17-16(18(28)25(2)20(24)29)27(19(23-17)26-12-6-3-7-13-26)14-8-11-22-15-9-4-5-10-21-15/h3-14H2,1-2H3,(H,21,22)
InChIKey
HUEFVFHHQJMQCE-UHFFFAOYSA-N
Synonyms

13dimethyl8(piperidin1yl)7(3((2E)piperidin2ylideneamino)propyl)37dihydro1Hpurine26dione
13dimethyl8piperidin1yl7(3(2345tetrahydropyridin6ylamino)propyl)purine26dione
Cn1c(=O)n(C)c2c(c1=O)n(CCCN=C1CCCCN1)c(n2)N1CCCCC1
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCCCC3)CCCNC4=NCCCC4
InChI=1SC20H31N7O2c1241716(18(28)25(2)20(24)29)27(19(2317)26126371326)148112215945102115h314H212H3(H2122)
MFCD03035927
ZINC000004004343
ZINC4004343

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Available files

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