Vitas-M small molecule compound
8-{(2E)-2-[(2Z)-2-bromo-3-phenylprop-2-en-1-ylidene]hydrazinyl}-3-methyl-7-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK054559
SMILES Br/C(=C\c1ccccc1)/C=N/Nc1nc2c(n1CCc1ccccc1)c(=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 C23H21BrN6O2 MW 493.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21BrN6O2/c1-29-20-19(21(31)27-23(29)32)30(13-12-16-8-4-2-5-9-16)22(26-20)28-25-15-18(24)14-17-10-6-3-7-11-17/h2-11,14-15H,12-13H2,1H3,(H,26,28)(H,27,31,32)/b18-14-,25-15+InChIKey
FHQGUMZOVQZQNO-NXYUMHSSSA-NSynonyms
369606-45-1369606451
8((2E)2((2Z)2BROMO3PHENYLPROP2EN1YLIDENE)HYDRAZINYL)3METHYL7(2PHENYLETHYL)37DIHYDRO1HPURINE26DIONE
8((2E)2((Z)2bromo3phenylprop2enylidene)hydrazinyl)3methyl7(2phenylethyl)purine26dione
8((E)2((Z)2bromo3phenylallylidene)hydrazinyl)3methyl7phenethyl1Hpurine26(3H7H)dione
BrC(=Cc1ccccc1)C=NNc1nc2c(n1CCc1ccccc1)c(=O)(nH)c(=O)n2C
CN1C2=C(C(=O)NC1=O)N(C(=N2)NN=CC(=CC3=CC=CC=C3)Br)CCC4=CC=CC=C4
InChI=1SC23H21BrN6O2c1292019(21(31)2723(29)32)30(1312168425916)22(2620)28251518(24)1417106371117h2111415H1213H21H3(H2628)(H273132)b18142515+
MFCD01051227
STK054559
ZINC000002322757
ZINC38161412
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