Vitas-M small molecule compound
7-(4-chlorobenzyl)-8-{(2E)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl}-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK058315
SMILES Clc1ccc(cc1)Cn1c(N/N=C(/c2ccc(cc2)Cl)\C)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 C21H18Cl2N6O2 MW 457.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18Cl2N6O2/c1-12(14-5-9-16(23)10-6-14)26-27-20-24-18-17(19(30)25-21(31)28(18)2)29(20)11-13-3-7-15(22)8-4-13/h3-10H,11H2,1-2H3,(H,24,27)(H,25,30,31)/b26-12+InChIKey
ZVKYDNOPPCEXHY-RPPGKUMJSA-NSynonyms
303971-45-1(E)7(4chlorobenzyl)8(2(1(4chlorophenyl)ethylidene)hydrazinyl)3methyl1Hpurine26(3H7H)dione
303971451
7(4CHLOROBENZYL)8((2E)2(1(4CHLOROPHENYL)ETHYLIDENE)HYDRAZINYL)3METHYL37DIHYDRO1HPURINE26DIONE
8((2E)2(1(4chlorophenyl)ethylidene)hydrazinyl)7((4chlorophenyl)methyl)3methylpurine26dione
CC(=NNC1=NC2=C(N1CC3=CC=C(C=C3)Cl)C(=O)NC(=O)N2C)C4=CC=C(C=C4)Cl
Clc1ccc(cc1)Cn1c(NN=C(c2ccc(cc2)Cl)C)nc2c1c(=O)(nH)c(=O)n2C
InChI=1SC21H18Cl2N6O2c112(145916(23)10614)262720241817(19(30)2521(31)28(18)2)29(20)11133715(22)8413h310H11H212H3(H2427)(H253031)b2612+
MFCD01142789
STK058315
ZINC000008809484
ZINC26675919
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