Vitas-M small molecule compound

ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-methylpiperazin-1-yl)methyl]-1H-1,2,3-triazole-4-carboxylate

Catalog ID
STK672661
SMILES CCOC(=O)c1nnn(c1CN1CCN(CC1)C)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 C13H20N8O3 MW 336.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H20N8O3/c1-3-23-13(22)10-9(8-20-6-4-19(2)5-7-20)21(18-15-10)12-11(14)16-24-17-12/h3-8H2,1-2H3,(H2,14,16)
InChIKey
ZHJGIGXKXTUMJK-UHFFFAOYSA-N
Synonyms
311314-87-1
1(4AMINOFURAZAN3YL)5(4METHYLPIPERAZIN1YLMETHYL)1H(123)TRIAZOLE4CARBOXYLICACIDETHYLESTER
311314871
CCOC(=O)C1=C(N(N=N1)C2=NON=C2N)CN3CCN(CC3)C
ETHYL1(4AMINO(125OXADIAZOL3YL))5((4METHYLPIPERAZINYL)METHYL)123TRIAZOLE4CARBOXYLATE
ETHYL1(4AMINO125OXADIAZOL3YL)5((4METHYL1PIPERAZINYL)METHYL)1H123TRIAZOLE4CARBOXYLATE
ethyl1(4amino125oxadiazol3yl)5((4methylpiperazin1yl)methyl)1H123triazole4carboxylate
ETHYL1(4AMINO125OXADIAZOL3YL)5((4METHYLPIPERAZIN1YL)METHYL)TRIAZOLE4CARBOXYLATE
ETHYL1(4AMINO125OXADIAZOL3YL)5((4METHYLPIPERAZINO)METHYL)1H123TRIAZOLE4CARBOXYLATE
InChI=1SC13H20N8O3c132313(22)109(8206419(2)5720)21(181510)1211(14)16241712h38H212H3(H21416)
MFCD00825446
ZINC000019359775
ZINC19359775

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.