[4-chloranyl-3-(2-pyridin-2-ylethynyl)phenyl]-(4-pyridin-2-ylpiperazin-1-yl)methanone

Systemtic Name: [4-chloranyl-3-(2-pyridin-2-ylethynyl)phenyl]-(4-pyridin-2-ylpiperazin-1-yl)methanone Openeye Name: [4-chloro-3-[2-(2-pyridyl)ethynyl]phenyl]-[4-(2-pyridyl)piperazin-1-yl]methanone CAS Name: [4-chloro-3-[2-(2-pyridinyl)ethynyl]phenyl]-[4-(2-pyridinyl)-1-piperazinyl]methanone IUPAC Name: [4-chloro-3-(2-pyridin-2-ylethynyl)phenyl]-(4-pyridin-2-ylpiperazin-1-yl)methanone Traditional Name: [4-chloro-3-[2-(2-pyridyl)ethynyl]phenyl]-[4-(2-pyridyl)piperazino]methanone Formula: C23H19ClN4O MolecularWeight: 402.87616

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)C(=O)C3=CC(=C(C=C3)Cl)C#CC4=CC=CC=N4

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)C(=O)C3=CC(=C(C=C3)Cl)C#CC4=CC=CC=N4

InChI

InChI=1S/C23H19ClN4O/c24-21-10-8-19(17-18(21)7-9-20-5-1-3-11-25-20)23(29)28-15-13-27(14-16-28)22-6-2-4-12-26-22/h1-6,8,10-12,17H,13-16H2