4-[(2,4-dichlorophenyl)amino]-7-(2-pyridin-3-ylethynyl)quinoline-3-carbonitrile

Systemtic Name: 4-[(2,4-dichlorophenyl)amino]-7-(2-pyridin-3-ylethynyl)quinoline-3-carbonitrile Openeye Name: 4-(2,4-dichloroanilino)-7-[2-(3-pyridyl)ethynyl]quinoline-3-carbonitrile CAS Name: 4-(2,4-dichloroanilino)-7-[2-(3-pyridinyl)ethynyl]-3-quinolinecarbonitrile IUPAC Name: 4-(2,4-dichloroanilino)-7-(2-pyridin-3-ylethynyl)quinoline-3-carbonitrile Traditional Name: 4-(2,4-dichloroanilino)-7-[2-(3-pyridyl)ethynyl]quinoline-3-carbonitrile Formula: C23H12Cl2N4 MolecularWeight: 415.27418

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C#CC2=CC3=NC=C(C(=C3C=C2)NC4=C(C=C(C=C4)Cl)Cl)C#N

Isomeric SMILES

C1=CC(=CN=C1)C#CC2=CC3=NC=C(C(=C3C=C2)NC4=C(C=C(C=C4)Cl)Cl)C#N

InChI

InChI=1S/C23H12Cl2N4/c24-18-6-8-21(20(25)11-18)29-23-17(12-26)14-28-22-10-15(5-7-19(22)23)3-4-16-2-1-9-27-13-16/h1-2,5-11,13-14H,(H,28,29)