Vitas-M small molecule compound

3-methyl-7-(2-phenylethyl)-8-[(2E)-2-(1-phenylethylidene)hydrazinyl]-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK064022
SMILES C/C(=N\Nc1nc2c(n1CCc1ccccc1)c(=O)[nH]c(=O)n2C)/c1ccccc1

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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 C22H22N6O2 MW 402.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N6O2/c1-15(17-11-7-4-8-12-17)25-26-21-23-19-18(20(29)24-22(30)27(19)2)28(21)14-13-16-9-5-3-6-10-16/h3-12H,13-14H2,1-2H3,(H,23,26)(H,24,29,30)/b25-15+
InChIKey
ZGJZFNNZOZYBNN-MFKUBSTISA-N
Synonyms
302800-77-7
(E)3methyl7phenethyl8(2(1phenylethylidene)hydrazinyl)1Hpurine26(3H7H)dione
302800777
3METHYL7(2PHENYLETHYL)8((2E)2(1PHENYLETHYLIDENE)HYDRAZINYL)37DIHYDRO1HPURINE26DIONE
3methyl7(2phenylethyl)8((2E)2(1phenylethylidene)hydrazinyl)purine26dione
CC(=NNC1=NC2=C(N1CCC3=CC=CC=C3)C(=O)NC(=O)N2C)C4=CC=CC=C4
CC(=NNc1nc2c(n1CCc1ccccc1)c(=O)(nH)c(=O)n2C)c1ccccc1
InChI=1SC22H22N6O2c115(17117481217)252621231918(20(29)2422(30)27(19)2)28(21)14131695361016h312H1314H212H3(H2326)(H242930)b2515+
MFCD01051213
STK064022
ZINC000004730242
ZINC19880992

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Available files

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