Vitas-M small molecule compound

N-{(1Z)-1-[2-(benzylamino)-1-cyano-2-oxoethylidene]-1H-isoindol-3-yl}-4-chlorobenzamide

Catalog ID
STK716308
SMILES N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1ccc(cc1)Cl)/C(=O)NCc1ccccc1

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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 C25H17ClN4O2 MW 440.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H17ClN4O2/c26-18-12-10-17(11-13-18)24(31)30-23-20-9-5-4-8-19(20)22(29-23)21(14-27)25(32)28-15-16-6-2-1-3-7-16/h1-13H,15H2,(H,28,32)(H,29,30,31)/b22-21-
InChIKey
NIPYALXELUTXGB-DQRAZIAOSA-N
Synonyms
896843-64-4
(Z)N(1(2(benzylamino)1cyano2oxoethylidene)1Hisoindol3yl)4chlorobenzamide
896843644
C1=CC=C(C=C1)CNC(=O)C(=C2C3=CC=CC=C3C(=N2)NC(=O)C4=CC=C(C=C4)Cl)C#N
InChI=1SC25H17ClN4O2c2618121017(111318)24(31)302320954819(20)22(2923)21(1427)25(32)2815166213716h113H15H2(H2832)(H293031)b2221
MFCD06601889
N#CC(=C1N=C(c2c1cccc2)NC(=O)c1ccc(cc1)Cl)C(=O)NCc1ccccc1
N((1Z)1(2(benzylamino)1cyano2oxoethylidene)1Hisoindol3yl)4chlorobenzamide
N((3Z)3(2(BENZYLAMINO)1CYANO2OXOETHYLIDENE)ISOINDOL1YL)4CHLOROBENZAMIDE
ZINC000013816688
ZINC13816688

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Available files

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