[4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]-(5-thiophen-2-ylpyridin-3-yl)methanone

Systemtic Name: [4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]-(5-thiophen-2-ylpyridin-3-yl)methanone Openeye Name: [4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]-[5-(2-thienyl)-3-pyridyl]methanone CAS Name: [4-(9H-fluoren-9-yl)-1-piperazin-4-iumyl]-(5-thiophen-2-yl-3-pyridinyl)methanone IUPAC Name: [4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]-(5-thiophen-2-ylpyridin-3-yl)methanone Traditional Name: [4-(9H-fluoren-9-yl)piperazin-4-ium-1-yl]-[5-(2-thienyl)-3-pyridyl]methanone Formula: C27H24N3OS+ MolecularWeight: 438.56396

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C2C3=CC=CC=C3C4=CC=CC=C24)C(=O)C5=CN=CC(=C5)C6=CC=CS6

Isomeric SMILES

C1CN(CC[NH+]1C2C3=CC=CC=C3C4=CC=CC=C24)C(=O)C5=CN=CC(=C5)C6=CC=CS6

InChI

InChI=1S/C27H23N3OS/c31-27(20-16-19(17-28-18-20)25-10-5-15-32-25)30-13-11-29(12-14-30)26-23-8-3-1-6-21(23)22-7-2-4-9-24(22)26/h1-10,15-18,26H,11-14H2/p+1