Vitas-M small molecule compound

4-tert-butyl-N-{(1Z)-1-[1-cyano-2-(morpholin-4-yl)-2-oxoethylidene]-1H-isoindol-3-yl}benzamide

Catalog ID
STK829203
SMILES N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1ccc(cc1)C(C)(C)C)/C(=O)N1CCOCC1

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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 C26H26N4O3 MW 442.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N4O3/c1-26(2,3)18-10-8-17(9-11-18)24(31)29-23-20-7-5-4-6-19(20)22(28-23)21(16-27)25(32)30-12-14-33-15-13-30/h4-11H,12-15H2,1-3H3,(H,28,29,31)/b22-21-
InChIKey
CIYUMCVOZBSOCF-DQRAZIAOSA-N
Synonyms
900893-38-1
(Z)4(tertbutyl)N(1(1cyano2morpholino2oxoethylidene)1Hisoindol3yl)benzamide
4tertbutylN((1Z)1(1cyano2(morpholin4yl)2oxoethylidene)1Hisoindol3yl)benzamide
4TERTBUTYLN((3Z)3(1CYANO2MORPHOLIN4YL2OXOETHYLIDENE)ISOINDOL1YL)BENZAMIDE
900893381
CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=NC(=C(C#N)C(=O)N3CCOCC3)C4=CC=CC=C42
InChI=1SC26H26N4O3c126(23)1810817(91118)24(31)292320754619(20)22(2823)21(1627)25(32)30121433151330h411H1215H213H3(H282931)b2221
MFCD06774771
N#CC(=C1N=C(c2c1cccc2)NC(=O)c1ccc(cc1)C(C)(C)C)C(=O)N1CCOCC1
ZINC000010233011
ZINC10233011

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Available files

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