quinolin-2-yl-[4-(thiophen-2-ylmethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: quinolin-2-yl-[4-(thiophen-2-ylmethyl)piperazin-4-ium-1-yl]methanone Openeye Name: 2-quinolyl-[4-(2-thienylmethyl)piperazin-4-ium-1-yl]methanone CAS Name: 2-quinolinyl-[4-(thiophen-2-ylmethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: quinolin-2-yl-[4-(thiophen-2-ylmethyl)piperazin-4-ium-1-yl]methanone Traditional Name: 2-quinolyl-[4-(2-thenyl)piperazin-4-ium-1-yl]methanone Formula: C19H20N3OS+ MolecularWeight: 338.4466

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CS2)C(=O)C3=NC4=CC=CC=C4C=C3

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CS2)C(=O)C3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C19H19N3OS/c23-19(18-8-7-15-4-1-2-6-17(15)20-18)22-11-9-21(10-12-22)14-16-5-3-13-24-16/h1-8,13H,9-12,14H2/p+1