Vitas-M small molecule compound

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

Catalog ID
STK000391
SMILES Brc1ccc(cc1)/C=N/NC(=O)c1nnn(c1CNc1ccccc1)c1nonc1N

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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 C19H16BrN9O2 MW 482.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16BrN9O2/c20-13-8-6-12(7-9-13)10-23-25-19(30)16-15(11-22-14-4-2-1-3-5-14)29(28-24-16)18-17(21)26-31-27-18/h1-10,22H,11H2,(H2,21,26)(H,25,30)/b23-10+
InChIKey
MDAILUJIXSLRFY-AUEPDCJTSA-N
Synonyms

1(4amino125oxadiazol3yl)5(anilinomethyl)N((E)(4bromophenyl)methylideneamino)triazole4carboxamide
1(4AMINO125OXADIAZOL3YL)N((E)(4BROMOPHENYL)METHYLIDENE)5((PHENYLAMINO)METHYL)1H123TRIAZOLE4CARBOHYDRAZIDE
Brc1ccc(cc1)C=NNC(=O)c1nnn(c1CNc1ccccc1)c1nonc1N
C1=CC=C(C=C1)NCC2=C(N=NN2C3=NON=C3N)C(=O)NN=CC4=CC=C(C=C4)Br
InChI=1SC19H16BrN9O2c20138612(7913)10232519(30)1615(1122144213514)29(282416)1817(21)26312718h11022H11H2(H22126)(H2530)b2310+
MFCD03339731
STK000391
ZINC000008915909
ZINC33453272

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Available files

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