Vitas-M small molecule compound

[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-phenyl-1H-1,2,3-triazol-4-yl](4-methylpiperazin-1-yl)methanone

Catalog ID
STK777646
SMILES CN1CCN(CC1)C(=O)c1nnn(c1c1ccccc1)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 C16H18N8O2 MW 354.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N8O2/c1-22-7-9-23(10-8-22)16(25)12-13(11-5-3-2-4-6-11)24(21-18-12)15-14(17)19-26-20-15/h2-6H,7-10H2,1H3,(H2,17,19)
InChIKey
YWXKXGJHLINBSY-UHFFFAOYSA-N
Synonyms

(1(4amino125oxadiazol3yl)5phenyl1H123triazol4yl)(4methylpiperazin1yl)methanone
(1(4AMINO125OXADIAZOL3YL)5PHENYLTRIAZOL4YL)(4METHYLPIPERAZIN1YL)METHANONE
CN1CCN(CC1)C(=O)C2=C(N(N=N2)C3=NON=C3N)C4=CC=CC=C4
InChI=1SC16H18N8O2c1227923(10822)16(25)1213(115324611)24(211812)1514(17)19262015h26H710H21H3(H21719)
MFCD05854776
ZINC000019858561
ZINC19858561

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Available files

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