Vitas-M small molecule compound
8-[(2E)-2-(2-chlorobenzylidene)hydrazinyl]-7-[(2Z)-3-chlorobut-2-en-1-yl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK095268
SMILES C/C(=C/Cn1c(N/N=C/c2ccccc2Cl)nc2c1c(=O)[nH]c(=O)n2C)/Cl
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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 C17H16Cl2N6O2 MW 407.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16Cl2N6O2/c1-10(18)7-8-25-13-14(24(2)17(27)22-15(13)26)21-16(25)23-20-9-11-5-3-4-6-12(11)19/h3-7,9H,8H2,1-2H3,(H,21,23)(H,22,26,27)/b10-7-,20-9+InChIKey
ZHHPCLQMGCLXTO-UPCWFAKJSA-NSynonyms
303969-60-0303969600
7((Z)3chlorobut2enyl)8((2E)2((2chlorophenyl)methylidene)hydrazinyl)3methylpurine26dione
8((2E)2(2CHLOROBENZYLIDENE)HYDRAZINYL)7((2Z)3CHLOROBUT2EN1YL)3METHYL37DIHYDRO1HPURINE26DIONE
8((E)2(2chlorobenzylidene)hydrazinyl)7((Z)3chlorobut2en1yl)3methyl1Hpurine26(3H7H)dione
CC(=CCn1c(NN=Cc2ccccc2Cl)nc2c1c(=O)(nH)c(=O)n2C)Cl
CC(=CCN1C2=C(N=C1NN=CC3=CC=CC=C3Cl)N(C(=O)NC2=O)C)Cl
InChI=1SC17H16Cl2N6O2c110(18)78251314(24(2)17(27)2215(13)26)2116(25)2320911534612(11)19h379H8H212H3(H2123)(H222627)b107209+
MFCD01553474
STK095268
ZINC000013512049
ZINC33605848
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