Vitas-M small molecule compound

4-[(E)-{2-[(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetyl]hydrazinylidene}methyl]-2-methoxyphenyl acetate

Catalog ID
STK079276
SMILES COc1cc(/C=N/NC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)ccc1OC(=O)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 C19H20N6O6 MW 428.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N6O6/c1-11(26)31-13-6-5-12(7-14(13)30-4)8-21-22-15(27)9-25-10-20-17-16(25)18(28)24(3)19(29)23(17)2/h5-8,10H,9H2,1-4H3,(H,22,27)/b21-8+
InChIKey
ACQVPVJIGTUPJK-ODCIPOBUSA-N
Synonyms
315218-02-1
(4((E)((2(13dimethyl26dioxopurin7yl)acetyl)hydrazinylidene)methyl)2methoxyphenyl)acetate
(E)4((2(2(13dimethyl26dioxo23dihydro1Hpurin7(6H)yl)acetyl)hydrazono)methyl)2methoxyphenylacetate
315218021
4((1E)2(2(13DIMETHYL26DIOXO(137TRIHYDROPURIN7YL))ACETYLAMINO)2AZAVINYL)2METHOXYPHENYLACETATE
4((E)(2((13dimethyl26dioxo1236tetrahydro7Hpurin7yl)acetyl)hydrazinylidene)methyl)2methoxyphenylacetate
CC(=O)OC1=C(C=C(C=C1)C=NNC(=O)CN2C=NC3=C2C(=O)N(C(=O)N3C)C)OC
COc1cc(C=NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)ccc1OC(=O)C
InChI=1SC19H20N6O6c111(26)31136512(714(13)304)8212215(27)92510201716(25)18(28)24(3)19(29)23(17)2h5810H9H214H3(H2227)b218+
MFCD02076870
STK079276
ZINC000001475035
ZINC33341552

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Available files

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