Vitas-M small molecule compound
3-methyl-7-(4-methylbenzyl)-8-{(2E)-2-[(2E)-3-phenylprop-2-en-1-ylidene]hydrazinyl}-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK023742
SMILES Cc1ccc(cc1)Cn1c(N/N=C/C=C/c2ccccc2)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 C23H22N6O2 MW 414.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N6O2/c1-16-10-12-18(13-11-16)15-29-19-20(28(2)23(31)26-21(19)30)25-22(29)27-24-14-6-9-17-7-4-3-5-8-17/h3-14H,15H2,1-2H3,(H,25,27)(H,26,30,31)/b9-6+,24-14+InChIKey
KDULMCGJOKUUKH-XWJCGCQVSA-NSynonyms
303970-03-8303970038
3methyl7((4methylphenyl)methyl)8((2E)2((E)3phenylprop2enylidene)hydrazinyl)purine26dione
3METHYL7(4METHYLBENZYL)8((2E)2((2E)3PHENYLPROP2EN1YLIDENE)HYDRAZINYL)37DIHYDRO1HPURINE26DIONE
3methyl7(4methylbenzyl)8((E)2((E)3phenylallylidene)hydrazinyl)1Hpurine26(3H7H)dione
CC1=CC=C(C=C1)CN2C3=C(N=C2NN=CC=CC4=CC=CC=C4)N(C(=O)NC3=O)C
Cc1ccc(cc1)Cn1c(NN=CC=Cc2ccccc2)nc2c1c(=O)(nH)c(=O)n2C
InChI=1SC23H22N6O2c116101218(131116)15291920(28(2)23(31)2621(19)30)2522(29)27241469177435817h314H15H212H3(H2527)(H263031)b96+2414+
MFCD01553419
STK023742
ZINC000002344592
ZINC33851165
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