Vitas-M small molecule compound

2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N'-[(E)-(4-nitrophenyl)methylidene]acetohydrazide

Catalog ID
STK067991
SMILES O=C(Cn1cnc2c1c(=O)n(C)c(=O)n2C)N/N=C/c1ccc(cc1)[N+](=O)[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 C16H15N7O5 MW 385.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15N7O5/c1-20-14-13(15(25)21(2)16(20)26)22(9-17-14)8-12(24)19-18-7-10-3-5-11(6-4-10)23(27)28/h3-7,9H,8H2,1-2H3,(H,19,24)/b18-7+
InChIKey
IYYFCZQKZDUQQE-CNHKJKLMSA-N
Synonyms
488797-07-5
(E)2(13dimethyl26dioxo23dihydro1Hpurin7(6H)yl)N(4nitrobenzylidene)acetohydrazide
2(13dimethyl26dioxo1236tetrahydro7Hpurin7yl)N((E)(4nitrophenyl)methylidene)acetohydrazide
2(13dimethyl26dioxopurin7yl)N((E)(4nitrophenyl)methylideneamino)acetamide
488797075
CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)NN=CC3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC16H15N7O5c1201413(15(25)21(2)16(20)26)22(91714)812(24)19187103511(6410)23(27)28h379H8H212H3(H1924)b187+
MFCD02726212
N((1E)2(4NITROPHENYL)1AZAVINYL)2(13DIMETHYL26DIOXO(137TRIHYDROPURIN7YL))ACETAMIDE
O=C(Cn1cnc2c1c(=O)n(C)c(=O)n2C)NN=Cc1ccc(cc1)(N+)(=O)(O)
STK067991
ZINC000001475258
ZINC33341636

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Available files

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