Vitas-M small molecule compound

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

Catalog ID
STK872084
SMILES O=C(Cn1cnc2c1c(=O)n(C)c(=O)n2C)N/N=C/c1ccc(cc1)C(F)(F)F

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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 C17H15F3N6O3 MW 408.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15F3N6O3/c1-24-14-13(15(28)25(2)16(24)29)26(9-21-14)8-12(27)23-22-7-10-3-5-11(6-4-10)17(18,19)20/h3-7,9H,8H2,1-2H3,(H,23,27)/b22-7+
InChIKey
GJYKZROJKIHDIJ-QPJQQBGISA-N
Synonyms
1095539-68-6
(E)2(13dimethyl26dioxo23dihydro1Hpurin7(6H)yl)N(4(trifluoromethyl)benzylidene)acetohydrazide
1095539686
2(13dimethyl26dioxo1236tetrahydro7Hpurin7yl)N((E)(4(trifluoromethyl)phenyl)methylidene)acetohydrazide
2(13dimethyl26dioxopurin7yl)N((E)(4(trifluoromethyl)phenyl)methylideneamino)acetamide
CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)NN=CC3=CC=C(C=C3)C(F)(F)F
InChI=1SC17H15F3N6O3c1241413(15(28)25(2)16(24)29)26(92114)812(27)23227103511(6410)17(1819)20h379H8H212H3(H2327)b227+
MFCD02076880
N((1E)2(4(TRIFLUOROMETHYL)PHENYL)1AZAVINYL)2(13DIMETHYL26DIOXO(137TRIHYDROPURIN7YL))ACETAMIDE
O=C(Cn1cnc2c1c(=O)n(C)c(=O)n2C)NN=Cc1ccc(cc1)C(F)(F)F
ZINC000005032175
ZINC33437024

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Available files

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