Vitas-M small molecule compound

2-benzyl-4-chloro-5-(3,4-dihydroisoquinolin-2(1H)-yl)pyridazin-3(2H)-one

Catalog ID
STK601698
SMILES Clc1c(cnn(c1=O)Cc1ccccc1)N1CCc2c(C1)cccc2

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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 C20H18ClN3O MW 351.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18ClN3O/c21-19-18(23-11-10-16-8-4-5-9-17(16)14-23)12-22-24(20(19)25)13-15-6-2-1-3-7-15/h1-9,12H,10-11,13-14H2
InChIKey
CHYTVGLFJQKIPP-UHFFFAOYSA-N
Synonyms
903854-32-0
2BENZYL4CHLORO5(34DIHYDRO1HISOQUINOLIN2YL)PYRIDAZIN3ONE
2benzyl4chloro5(34dihydroisoquinolin2(1H)yl)pyridazin3(2H)one
903854320
C1CN(CC2=CC=CC=C21)C3=C(C(=O)N(N=C3)CC4=CC=CC=C4)Cl
InChI=1SC20H18ClN3Oc211918(23111016845917(16)1423)122224(20(19)25)13156213715h1912H10111314H2
MFCD08285311
ZINC000006661927
ZINC06661927
ZINC6661927

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Available files

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