Vitas-M small molecule compound

1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(diethylamino)methyl]-N'-[(E)-(3-nitrophenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide

Catalog ID
STK662522
SMILES CCN(Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccc(c1)[N+](=O)[O-])CC

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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 C17H20N10O4 MW 428.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N10O4/c1-3-25(4-2)10-13-14(20-24-26(13)16-15(18)22-31-23-16)17(28)21-19-9-11-6-5-7-12(8-11)27(29)30/h5-9H,3-4,10H2,1-2H3,(H2,18,22)(H,21,28)/b19-9+
InChIKey
YKNIWQDSKRJHKQ-DJKKODMXSA-N
Synonyms

1(4amino125oxadiazol3yl)5((diethylamino)methyl)N((E)(3nitrophenyl)methylidene)1H123triazole4carbohydrazide
1(4AMINO125OXADIAZOL3YL)5((DIETHYLAMINO)METHYL)N(3NITROBENZYLIDENE)1H123TRIAZOLE4CARBOHYDRAZIDE
1(4AMINO125OXADIAZOL3YL)5(DIETHYLAMINOMETHYL)N((E)(3NITROPHENYL)METHYLIDENEAMINO)TRIAZOLE4CARBOXAMIDE
CCN(CC)CC1=C(N=NN1C2=NON=C2N)C(=O)NN=CC3=CC(=CC=C3)(N+)(=O)(O)
CCN(Cc1c(nnn1c1nonc1N)C(=O)NN=Cc1cccc(c1)(N+)(=O)(O))CC
InChI=1SC17H20N10O4c1325(42)101314(202426(13)1615(18)22312316)17(28)211991165712(811)27(29)30h59H3410H212H3(H21822)(H2128)b199+
MFCD00759788
ZINC000002187775
ZINC33349942

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Available files

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