[2-(5-chloranylthiophen-2-yl)quinolin-4-yl]-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone

Systemtic Name: [2-(5-chloranylthiophen-2-yl)quinolin-4-yl]-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone Openeye Name: [2-(5-chloro-2-thienyl)-4-quinolyl]-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone CAS Name: [2-(5-chloro-2-thiophenyl)-4-quinolinyl]-[4-(2-pyridin-1-iumyl)-1-piperazinyl]methanone IUPAC Name: [2-(5-chlorothiophen-2-yl)quinolin-4-yl]-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone Traditional Name: [2-(5-chloro-2-thienyl)-4-quinolyl]-(4-pyridin-1-ium-2-ylpiperazino)methanone Formula: C23H20ClN4OS+ MolecularWeight: 435.9491

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(S5)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(S5)Cl

InChI

InChI=1S/C23H19ClN4OS/c24-21-9-8-20(30-21)19-15-17(16-5-1-2-6-18(16)26-19)23(29)28-13-11-27(12-14-28)22-7-3-4-10-25-22/h1-10,15H,11-14H2/p+1