[2-[(3-fluorophenyl)methylsulfanyl]pyridin-3-yl]-(4-pyridin-2-ylpiperazin-1-yl)methanone

Systemtic Name: [2-[(3-fluorophenyl)methylsulfanyl]pyridin-3-yl]-(4-pyridin-2-ylpiperazin-1-yl)methanone Openeye Name: [2-[(3-fluorophenyl)methylsulfanyl]-3-pyridyl]-[4-(2-pyridyl)piperazin-1-yl]methanone CAS Name: [2-[(3-fluorophenyl)methylthio]-3-pyridinyl]-[4-(2-pyridinyl)-1-piperazinyl]methanone IUPAC Name: [2-[(3-fluorophenyl)methylsulfanyl]pyridin-3-yl]-(4-pyridin-2-ylpiperazin-1-yl)methanone Traditional Name: [2-[(3-fluorobenzyl)thio]-3-pyridyl]-[4-(2-pyridyl)piperazino]methanone Formula: C22H21FN4OS MolecularWeight: 408.491743

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)C(=O)C3=C(N=CC=C3)SCC4=CC(=CC=C4)F

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)C(=O)C3=C(N=CC=C3)SCC4=CC(=CC=C4)F

InChI

InChI=1S/C22H21FN4OS/c23-18-6-3-5-17(15-18)16-29-21-19(7-4-10-25-21)22(28)27-13-11-26(12-14-27)20-8-1-2-9-24-20/h1-10,15H,11-14,16H2