Vitas-M small molecule compound

N-[(3Z,4Z)-4-(azepan-2-ylidene)-5-oxo-1-phenylpyrazolidin-3-ylidene]-2-methoxybenzamide

Catalog ID
STK531367
SMILES COc1ccccc1C(=O)/N=C/1\NN(C(=O)\C1=C/1\CCCCCN1)c1ccccc1

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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 C23H24N4O3 MW 404.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N4O3/c1-30-19-14-8-7-12-17(19)22(28)25-21-20(18-13-6-3-9-15-24-18)23(29)27(26-21)16-10-4-2-5-11-16/h2,4-5,7-8,10-12,14,24H,3,6,9,13,15H2,1H3,(H,25,26,28)/b20-18-
InChIKey
NYGCXRPDPAFIFK-ZZEZOPTASA-N
Synonyms

(Z)N((Z)4(azepan2ylidene)5oxo1phenylpyrazolidin3ylidene)2methoxybenzamide
COc1ccccc1C(=O)N=C1NN(C(=O)C1=C1CCCCCN1)c1ccccc1
MFCD01949046
N((3Z4Z)4(azepan2ylidene)5oxo1phenylpyrazolidin3ylidene)2methoxybenzamide
ZINC000006174940

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Available files

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