Vitas-M small molecule compound

2-chloro-5-nitro-N-[2-(4-propanoylpiperazin-1-yl)phenyl]benzamide

Catalog ID
STK259126
SMILES CCC(=O)N1CCN(CC1)c1ccccc1NC(=O)c1cc(ccc1Cl)[N+](=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 C20H21ClN4O4 MW 416.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21ClN4O4/c1-2-19(26)24-11-9-23(10-12-24)18-6-4-3-5-17(18)22-20(27)15-13-14(25(28)29)7-8-16(15)21/h3-8,13H,2,9-12H2,1H3,(H,22,27)
InChIKey
LOGLZQMKNULMBJ-UHFFFAOYSA-N
Synonyms

2chloro5nitroN(2(4propanoylpiperazin1yl)phenyl)benzamide
CCC(=O)N1CCN(CC1)c1ccccc1NC(=O)c1cc(ccc1Cl)(N+)(=O)(O)
CCC(=O)N1CCN(CC1)C2=CC=CC=C2NC(=O)C3=C(C=CC(=C3)(N+)(=O)(O))Cl
InChI=1SC20H21ClN4O4c1219(26)2411923(101224)18643517(18)2220(27)151314(25(28)29)7816(15)21h3813H2912H21H3(H2227)
MFCD05852484
ZINC000006709312
ZINC06709312
ZINC6709312

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Available files

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