Vitas-M small molecule compound

N-(1,3-benzodioxol-5-yl)-2-[3-(2,5-dimethylphenyl)-6-oxopyridazin-1(6H)-yl]butanamide

Catalog ID
STK358946
SMILES CCC(n1nc(ccc1=O)c1cc(C)ccc1C)C(=O)Nc1ccc2c(c1)OCO2

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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 C23H23N3O4 MW 405.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N3O4/c1-4-19(23(28)24-16-7-9-20-21(12-16)30-13-29-20)26-22(27)10-8-18(25-26)17-11-14(2)5-6-15(17)3/h5-12,19H,4,13H2,1-3H3,(H,24,28)
InChIKey
LXQTUFXJJVWIJR-UHFFFAOYSA-N
Synonyms

CCC(C(=O)NC1=CC2=C(C=C1)OCO2)N3C(=O)C=CC(=N3)C4=C(C=CC(=C4)C)C
InChI=1SC23H23N3O4c1419(23(28)2416792021(1216)30132920)2622(27)10818(2526)171114(2)5615(17)3h51219H413H213H3(H2428)
MFCD11852269
N(13benzodioxol5yl)2(3(25dimethylphenyl)6oxopyridazin1(6H)yl)butanamide
N(13benzodioxol5yl)2(3(25dimethylphenyl)6oxopyridazin1yl)butanamide
ZINC000020095419
ZINC000020095421

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Available files

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