Vitas-M small molecule compound
7-[3-(4-bromophenoxy)-2-hydroxypropyl]-8-{(2E)-2-[(2Z)-2-bromo-3-phenylprop-2-en-1-ylidene]hydrazinyl}-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK072428
SMILES OC(Cn1c(N/N=C/C(=C/c2ccccc2)/Br)nc2c1c(=O)[nH]c(=O)n2C)COc1ccc(cc1)Br
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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 C24H22Br2N6O4 MW 618.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22Br2N6O4/c1-31-21-20(22(34)29-24(31)35)32(13-18(33)14-36-19-9-7-16(25)8-10-19)23(28-21)30-27-12-17(26)11-15-5-3-2-4-6-15/h2-12,18,33H,13-14H2,1H3,(H,28,30)(H,29,34,35)/b17-11-,27-12+InChIKey
WQHCRBPIIXOKSS-BPHOEZLFSA-NSynonyms
7(3(4BROMOPHENOXY)2HYDROXYPROPYL)8((2E)2((2Z)2BROMO3PHENYLPROP2EN1YLIDENE)HYDRAZINYL)3METHYL37DIHYDRO1HPURINE26DIONE
7(3(4BROMOPHENOXY)2HYDROXYPROPYL)8((2E)2((2Z)2BROMO3PHENYLPROP2EN1YLIDENE)HYDRAZINYL)6HYDROXY3METHYL37DIHYDRO2HPURIN2ONE
7(3(4bromophenoxy)2hydroxypropyl)8((2E)2((Z)2bromo3phenylprop2enylidene)hydrazinyl)3methylpurine26dione
8((E)2((Z)2bromo3phenylallylidene)hydrazinyl)7(3(4bromophenoxy)2hydroxypropyl)3methyl1Hpurine26(3H7H)dione
CN1C2=C(C(=O)NC1=O)N(C(=N2)NN=CC(=CC3=CC=CC=C3)Br)CC(COC4=CC=C(C=C4)Br)O
InChI=1SC24H22Br2N6O4c1312120(22(34)2924(31)35)32(1318(33)1436199716(25)81019)23(2821)30271217(26)11155324615h2121833H1314H21H3(H2830)(H293435)b17112712+
MFCD01142843
OC(Cn1c(NN=CC(=Cc2ccccc2)Br)nc2c1c(=O)(nH)c(=O)n2C)COc1ccc(cc1)Br
STK072428
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