Vitas-M small molecule compound
1-benzyl-8-{(2E)-2-[(6-methoxyquinolin-2-yl)methylidene]hydrazinyl}-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK697842
SMILES COc1ccc2c(c1)ccc(n2)/C=N/Nc1nc2c(n1C)c(=O)n(c(=O)n2C)Cc1ccccc1
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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 C25H23N7O3 MW 469.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N7O3/c1-30-21-22(31(2)25(34)32(23(21)33)15-16-7-5-4-6-8-16)28-24(30)29-26-14-18-10-9-17-13-19(35-3)11-12-20(17)27-18/h4-14H,15H2,1-3H3,(H,28,29)/b26-14+InChIKey
KQJGDFIZZXLYJW-VULFUBBASA-NSynonyms
(E)1benzyl8(2((6methoxyquinolin2yl)methylene)hydrazinyl)37dimethyl1Hpurine26(3H7H)dione
1benzyl8((2E)2((6methoxyquinolin2yl)methylidene)hydrazinyl)37dimethyl37dihydro1Hpurine26dione
1benzyl8((2E)2((6methoxyquinolin2yl)methylidene)hydrazinyl)37dimethylpurine26dione
CN1C2=C(N=C1NN=CC3=NC4=C(C=C3)C=C(C=C4)OC)N(C(=O)N(C2=O)CC5=CC=CC=C5)C
COc1ccc2c(c1)ccc(n2)C=NNc1nc2c(n1C)c(=O)n(c(=O)n2C)Cc1ccccc1
InChI=1SC25H23N7O3c1302122(31(2)25(34)32(23(21)33)15167546816)2824(30)29261418109171319(353)111220(17)2718h414H15H213H3(H2829)b2614+
MFCD02996327
ZINC000009275576
ZINC102629630
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