Vitas-M small molecule compound

4-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)-N-(pyridin-3-ylmethyl)butanamide

Catalog ID
STK762059
SMILES O=C(NCc1cccnc1)CCCn1c(=O)c2cccc3c2c(c1=O)ccc3

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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 C22H19N3O3 MW 373.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N3O3/c26-19(24-14-15-5-3-11-23-13-15)10-4-12-25-21(27)17-8-1-6-16-7-2-9-18(20(16)17)22(25)28/h1-3,5-9,11,13H,4,10,12,14H2,(H,24,26)
InChIKey
CWPZSHSISUCXSC-UHFFFAOYSA-N
Synonyms
309735-92-0
309735920
4(13BIS(OXIDANYLIDENE)BENZO(DE)ISOQUINOLIN2YL)N(PYRIDIN3YLMETHYL)BUTANAMIDE
4(13DIKETOBENZO(DE)ISOQUINOLIN2YL)N(3PYRIDYLMETHYL)BUTYRAMIDE
4(13DIOXO1H3HBENZO(DE)ISOQUINOLIN2YL)NPYRIDIN3YLMETHYLBUTYRAMIDE
4(13dioxo1Hbenzo(de)isoquinolin2(3H)yl)N(pyridin3ylmethyl)butanamide
4(13DIOXO2BENZO(DE)ISOQUINOLINYL)N(3PYRIDINYLMETHYL)BUTANAMIDE
4(13DIOXOBENZO(DE)ISOQUINOLIN2YL)N(PYRIDIN3YLMETHYL)BUTANAMIDE
C1=CC2=C3C(=C1)C(=O)N(C(=O)C3=CC=C2)CCCC(=O)NCC4=CN=CC=C4
InChI=1SC22H19N3O3c2619(2414155311231315)104122521(27)178161672918(20(16)17)22(25)28h13591113H4101214H2(H2426)
MFCD00792049
ZINC000004058835
ZINC04058835
ZINC4058835

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Available files

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