Vitas-M small molecule compound

8-[(2E)-2-(4-ethoxybenzylidene)hydrazinyl]-7-(2-hydroxyethyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK530196
SMILES OCCn1c(N/N=C/c2ccc(cc2)OCC)nc2c1c(=O)n(c(=O)n2C)C

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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 C18H22N6O4 MW 386.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N6O4/c1-4-28-13-7-5-12(6-8-13)11-19-21-17-20-15-14(24(17)9-10-25)16(26)23(3)18(27)22(15)2/h5-8,11,25H,4,9-10H2,1-3H3,(H,20,21)/b19-11+
InChIKey
ZIOZPIQAEYJTEU-YBFXNURJSA-N
Synonyms

8((2E)2((4ethoxyphenyl)methylidene)hydrazinyl)7(2hydroxyethyl)13dimethylpurine26dione
8((2E)2(4ethoxybenzylidene)hydrazinyl)7(2hydroxyethyl)13dimethyl37dihydro1Hpurine26dione
8(2(4ethoxybenzylidene)hydrazinyl)7(2hydroxyethyl)13dimethyl1Hpurine26(3H7H)dione
CCOC1=CC=C(C=C1)C=NNC2=NC3=C(N2CCO)C(=O)N(C(=O)N3C)C
InChI=1SC18H22N6O4c1428137512(6813)11192117201514(24(17)91025)16(26)23(3)18(27)22(15)2h581125H4910H213H3(H2021)b1911+
MFCD02234786
OCCn1c(NN=Cc2ccc(cc2)OCC)nc2c1c(=O)n(c(=O)n2C)C
ZINC000004816123
ZINC35128914

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Available files

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