Vitas-M small molecule compound
1,3-dimethyl-7-{2-[(2E)-piperidin-2-ylideneamino]ethyl}-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK677701
SMILES Cn1c(=O)n(C)c2c(c1=O)n(CC/N=C/1\CCCCN1)cn2
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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 C14H20N6O2 MW 304.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H20N6O2/c1-18-12-11(13(21)19(2)14(18)22)20(9-17-12)8-7-16-10-5-3-4-6-15-10/h9H,3-8H2,1-2H3,(H,15,16)InChIKey
NQEGISPISBHSNZ-UHFFFAOYSA-NSynonyms
13dimethyl7(2((2E)piperidin2ylideneamino)ethyl)37dihydro1Hpurine26dione
13dimethyl7(2(2345tetrahydropyridin6ylamino)ethyl)purine26dione
Cn1c(=O)n(C)c2c(c1=O)n(CCN=C1CCCCN1)cn2
CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCNC3=NCCCC3
InChI=1SC14H20N6O2c1181211(13(21)19(2)14(18)22)20(91712)87161053461510h9H38H212H3(H1516)
MFCD02934311
ZINC000005687310
ZINC5687310
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