Vitas-M small molecule compound

8-{(2E)-2-[1-(2-bromoethyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]hydrazinyl}-6-hydroxy-3-methyl-7-(1-phenylethyl)-3,7-dihydro-2H-purin-2-one

Catalog ID
STK646975
SMILES BrCCN1c2ccccc2/C(=N\Nc2nc3c(n2C(c2ccccc2)C)c(O)nc(=O)n3C)/C1=O

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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 C24H22BrN7O3 MW 536.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22BrN7O3/c1-14(15-8-4-3-5-9-15)32-19-20(30(2)24(35)27-21(19)33)26-23(32)29-28-18-16-10-6-7-11-17(16)31(13-12-25)22(18)34/h3-11,14H,12-13H2,1-2H3,(H,26,29)(H,27,33,35)/b28-18+
InChIKey
MOCCNCJAFDNWIV-MTDXEUNCSA-N
Synonyms

8((2E)2(1(2bromoethyl)2oxo12dihydro3Hindol3ylidene)hydrazinyl)6hydroxy3methyl7(1phenylethyl)37dihydro2Hpurin2one
8((2E)2(1(2bromoethyl)2oxoindol3ylidene)hydrazinyl)3methyl7(1phenylethyl)purine26dione
BrCCN1c2ccccc2C(=NNc2nc3c(n2C(c2ccccc2)C)c(O)nc(=O)n3C)C1=O
CC(C1=CC=CC=C1)N2C3=C(N=C2NN=C4C5=CC=CC=C5N(C4=O)CCBr)N(C(=O)NC3=O)C
InChI=1SC24H22BrN7O3c114(158435915)321920(30(2)24(35)2721(19)33)2623(32)2928181610671117(16)31(131225)22(18)34h31114H1213H212H3(H2629)(H273335)b2818+
MFCD18164426
ZINC000097968823
ZINC000097968824

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Available files

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