Vitas-M small molecule compound

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

Catalog ID
STK764589
SMILES OCCn1c(N/N=C/c2ccc(cc2)N(C)C)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 C18H23N7O3 MW 385.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23N7O3/c1-22(2)13-7-5-12(6-8-13)11-19-21-17-20-15-14(25(17)9-10-26)16(27)24(4)18(28)23(15)3/h5-8,11,26H,9-10H2,1-4H3,(H,20,21)/b19-11+
InChIKey
RICRBSPCZWCVQA-YBFXNURJSA-N
Synonyms

(E)8(2(4(dimethylamino)benzylidene)hydrazinyl)7(2hydroxyethyl)13dimethyl1Hpurine26(3H7H)dione
8((2E)2((4(dimethylamino)phenyl)methylidene)hydrazinyl)7(2hydroxyethyl)13dimethylpurine26dione
8((2E)2(4(dimethylamino)benzylidene)hydrazinyl)7(2hydroxyethyl)13dimethyl37dihydro1Hpurine26dione
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NN=CC3=CC=C(C=C3)N(C)C)CCO
InChI=1SC18H23N7O3c122(2)137512(6813)11192117201514(25(17)91026)16(27)24(4)18(28)23(15)3h581126H910H214H3(H2021)b1911+
MFCD02237804
OCCn1c(NN=Cc2ccc(cc2)N(C)C)nc2c1c(=O)n(c(=O)n2C)C
ZINC000004170705
ZINC83310863

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Available files

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