Vitas-M small molecule compound

4-chloro-5-(3,4-dihydroisoquinolin-2(1H)-yl)benzene-1,2-dicarbonitrile

Catalog ID
STK326494
SMILES N#Cc1cc(N2CCc3c(C2)cccc3)c(cc1C#N)Cl

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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 C17H12ClN3 MW 293.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12ClN3/c18-16-7-14(9-19)15(10-20)8-17(16)21-6-5-12-3-1-2-4-13(12)11-21/h1-4,7-8H,5-6,11H2
InChIKey
QEKCKLZVCIEJPN-UHFFFAOYSA-N
Synonyms
355435-41-5
355435415
4CHLORO5(34DIHYDRO1HISOQUINOLIN2YL)BENZENE12DICARBONITRILE
4chloro5(34dihydroisoquinolin2(1H)yl)benzene12dicarbonitrile
4chloro5(34dihydroisoquinolin2(1H)yl)phthalonitrile
C1CN(CC2=CC=CC=C21)C3=C(C=C(C(=C3)C#N)C#N)Cl
InChI=1SC17H12ClN3c1816714(919)15(1020)817(16)216512312413(12)1121h1478H5611H2
MFCD02376059
ZINC000000529189
ZINC00529189
ZINC529189

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Available files

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