Vitas-M small molecule compound
2-[(E)-{2-[(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetyl]hydrazinylidene}methyl]benzoic acid
Catalog ID
STK032220
SMILES O=C(Cn1cnc2c1c(=O)n(C)c(=O)n2C)N/N=C/c1ccccc1C(=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 C17H16N6O5 MW 384.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N6O5/c1-21-14-13(15(25)22(2)17(21)28)23(9-18-14)8-12(24)20-19-7-10-5-3-4-6-11(10)16(26)27/h3-7,9H,8H2,1-2H3,(H,20,24)(H,26,27)/b19-7+InChIKey
SGIQNLCOFORVQH-FBCYGCLPSA-NSynonyms
315218-20-3(E)2((2(2(13dimethyl26dioxo23dihydro1Hpurin7(6H)yl)acetyl)hydrazono)methyl)benzoicacid
2((1E)2(2(13DIMETHYL26DIOXO(137TRIHYDROPURIN7YL))ACETYLAMINO)2AZAVINYL)BENZOICACID
2((E)((2(13dimethyl26dioxopurin7yl)acetyl)hydrazinylidene)methyl)benzoicacid
2((E)(2((13dimethyl26dioxo1236tetrahydro7Hpurin7yl)acetyl)hydrazinylidene)methyl)benzoicacid
315218203
CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)NN=CC3=CC=CC=C3C(=O)O
InChI=1SC17H16N6O5c1211413(15(25)22(2)17(21)28)23(91814)812(24)2019710534611(10)16(26)27h379H8H212H3(H2024)(H2627)b197+
MFCD02076887
O=C(Cn1cnc2c1c(=O)n(C)c(=O)n2C)NN=Cc1ccccc1C(=O)O
STK032220
ZINC000001475029
ZINC33341547
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