Vitas-M small molecule compound

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

Catalog ID
STK677773
SMILES Cn1c(=O)n(C)c2c(c1=O)n(CCC/N=C/1\CCCN1)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)8-4-7-16-10-5-3-6-15-10/h9H,3-8H2,1-2H3,(H,15,16)
InChIKey
JJWHIJLFKFHIAG-UHFFFAOYSA-N
Synonyms

13dimethyl7(3((2E)pyrrolidin2ylideneamino)propyl)37dihydro1Hpurine26dione
13DIMETHYL7(3((2E)PYRROLIDINYLIDENEAMINO)PROPYL)37DIHYDRO1HPURINE26DIONE
13DIMETHYL7(3(2PYRROLIDINYLIDENEAMINO)PROPYL)37DIHYDRO1HPURINE26DIONE
13DIMETHYL7(3(PYRROLIDIN2YLIDENEAMINO)PROPYL)37DIHYDROPURINE26DIONE
7(3(34DIHYDRO2HPYRROL5YLAMINO)PROPYL)13DIMETHYLPURINE26DIONE
Cn1c(=O)n(C)c2c(c1=O)n(CCCN=C1CCCN1)cn2
CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCCNC3=NCCC3
InChI=1SC14H20N6O2c1181211(13(21)19(2)14(18)22)20(91712)84716105361510h9H38H212H3(H1516)
MFCD02934730
ZINC000004162814
ZINC4162814

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Available files

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