Vitas-M small molecule compound
8-[(2E)-2-benzylidenehydrazinyl]-3-methyl-7-pentyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK834556
SMILES CCCCCn1c(N/N=C/c2ccccc2)nc2c1c(=O)[nH]c(=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 C18H22N6O2 MW 354.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N6O2/c1-3-4-8-11-24-14-15(23(2)18(26)21-16(14)25)20-17(24)22-19-12-13-9-6-5-7-10-13/h5-7,9-10,12H,3-4,8,11H2,1-2H3,(H,20,22)(H,21,25,26)/b19-12+InChIKey
VDWHFKNAJNOFSP-XDHOZWIPSA-NSynonyms
300591-03-1(E)8(2benzylidenehydrazinyl)3methyl7pentyl1Hpurine26(3H7H)dione
300591031
8((2E)2benzylidenehydrazinyl)3methyl7pentyl37dihydro1Hpurine26dione
8((2E)2BENZYLIDENEHYDRAZINYL)3METHYL7PENTYLPURINE26DIONE
CCCCCn1c(NN=Cc2ccccc2)nc2c1c(=O)(nH)c(=O)n2C
CCCCCN1C2=C(N=C1NN=CC3=CC=CC=C3)N(C(=O)NC2=O)C
InChI=1SC18H22N6O2c134811241415(23(2)18(26)2116(14)25)2017(24)2219121396571013h5791012H34811H212H3(H2022)(H212526)b1912+
MFCD01550911
ZINC000004728994
ZINC33908448
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