Vitas-M small molecule compound

(8E)-8-[(2E)-(2-chlorobenzylidene)hydrazinylidene]-1,3-dimethyl-7-(naphthalen-1-ylmethyl)-3,7,8,9-tetrahydro-1H-purine-2,6-dione

Catalog ID
STL053432
SMILES Clc1ccccc1/C=N/N=c/1\[nH]c2c(n1Cc1cccc3c1cccc3)c(=O)n(c(=O)n2C)C

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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 C25H21ClN6O2 MW 472.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21ClN6O2/c1-30-22-21(23(33)31(2)25(30)34)32(15-18-11-7-10-16-8-3-5-12-19(16)18)24(28-22)29-27-14-17-9-4-6-13-20(17)26/h3-14H,15H2,1-2H3,(H,28,29)/b27-14+
InChIKey
NSEQVGTZJYGVAL-MZJWZYIUSA-N
Synonyms
478252-76-5
(8E)8((2E)(2chlorobenzylidene)hydrazinylidene)13dimethyl7(naphthalen1ylmethyl)3789tetrahydro1Hpurine26dione
478252765
8((2E)2((2CHLOROPHENYL)METHYLIDENE)HYDRAZINYL)13DIMETHYL7(NAPHTHALEN1YLMETHYL)PURINE26DIONE
8(2(2CHLOROBENZYLIDENE)HYDRAZINYL)13DIMETHYL7(NAPHTHALEN1YLMETHYL)1HPURINE26(3H7H)DIONE
Clc1ccccc1C=NN=c1(nH)c2c(n1Cc1cccc3c1cccc3)c(=O)n(c(=O)n2C)C
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NN=CC3=CC=CC=C3Cl)CC4=CC=CC5=CC=CC=C54
InChI=1SC25H21ClN6O2c1302221(23(33)31(2)25(30)34)32(151811710168351219(16)18)24(2822)292714179461320(17)26h314H15H212H3(H2829)b2714+
MFCD05736903
ZINC000009158102
ZINC33332528

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Available files

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