Vitas-M small molecule compound

4-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)-N-(3-methyl-1-phenyl-1H-pyrazol-5-yl)butanamide

Catalog ID
STK807141
SMILES O=C(Nc1cc(nn1c1ccccc1)C)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 C26H22N4O3 MW 438.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22N4O3/c1-17-16-22(30(28-17)19-10-3-2-4-11-19)27-23(31)14-7-15-29-25(32)20-12-5-8-18-9-6-13-21(24(18)20)26(29)33/h2-6,8-13,16H,7,14-15H2,1H3,(H,27,31)
InChIKey
YNJBLXNVCIFBMM-UHFFFAOYSA-N
Synonyms
956791-34-7
4(13dioxo1Hbenzo(de)isoquinolin2(3H)yl)N(3methyl1phenyl1Hpyrazol5yl)butanamide
4(13DIOXOBENZO(DE)ISOQUINOLIN2YL)N(5METHYL2PHENYLPYRAZOL3YL)BUTANAMIDE
956791347
CC1=NN(C(=C1)NC(=O)CCCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O)C5=CC=CC=C5
InChI=1SC26H22N4O3c1171622(30(2817)19103241119)2723(31)147152925(32)20125818961321(24(18)20)26(29)33h2681316H71415H21H3(H2731)
MFCD03621296
ZINC000009722456
ZINC09722456
ZINC9722456

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Available files

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