Vitas-M small molecule compound
7-[(2E)-but-2-en-1-yl]-8-[(2E)-2-(4-chlorobenzylidene)hydrazinyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK527695
SMILES C/C=C/Cn1c(N/N=C/c2ccc(cc2)Cl)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 C17H17ClN6O2 MW 372.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17ClN6O2/c1-3-4-9-24-13-14(23(2)17(26)21-15(13)25)20-16(24)22-19-10-11-5-7-12(18)8-6-11/h3-8,10H,9H2,1-2H3,(H,20,22)(H,21,25,26)/b4-3+,19-10+InChIKey
MSKOGVLYAGITEA-VAKDNYGLSA-NSynonyms
306732-89-8306732898
7((2E)but2en1yl)8((2E)2(4chlorobenzylidene)hydrazinyl)3methyl37dihydro1Hpurine26dione
7((2E)BUT2ENYL)8(((1E)2(4CHLOROPHENYL)1AZAVINYL)AMINO)3METHYL137TRIHYDROPURINE26DIONE
7((E)but2en1yl)8((E)2(4chlorobenzylidene)hydrazinyl)3methyl1Hpurine26(3H7H)dione
7((E)but2enyl)8((2E)2((4chlorophenyl)methylidene)hydrazinyl)3methylpurine26dione
CC=CCn1c(NN=Cc2ccc(cc2)Cl)nc2c1c(=O)(nH)c(=O)n2C
CC=CCN1C2=C(N=C1NN=CC3=CC=C(C=C3)Cl)N(C(=O)NC2=O)C
InChI=1SC17H17ClN6O2c1349241314(23(2)17(26)2115(13)25)2016(24)221910115712(18)8611h3810H9H212H3(H2022)(H212526)b43+1910+
MFCD01554621
ZINC000004730455
ZINC32117019
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