Vitas-M small molecule compound

(5Z)-3-(4-carboxybenzyl)-5-[(phenylcarbamoyl)imino]-4,5-dihydro-1,2,3-oxadiazol-3-ium-4-ide

Catalog ID
STK677424
SMILES O=C(Nc1ccccc1)/N=C/1\ON=[N+]([CH-]1)Cc1ccc(cc1)C(=O)O

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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 C17H14N4O4 MW 338.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14N4O4/c22-16(23)13-8-6-12(7-9-13)10-21-11-15(25-20-21)19-17(24)18-14-4-2-1-3-5-14/h1-9,11H,10H2,(H,18,24)(H,22,23)/b19-15-
InChIKey
XRKSBYHCIWTBCZ-CYVLTUHYSA-N
Synonyms

(5Z)3(4carboxybenzyl)5((phenylcarbamoyl)imino)45dihydro123oxadiazol3ium4ide
MFCD02928346
O=C(Nc1ccccc1)N=C1ON=(N+)((CH)1)Cc1ccc(cc1)C(=O)O
ZINC000006529887

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Available files

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