(4-fluorophenyl)-[4-[(2-sulfanylidene-1H-pyridin-3-yl)carbonyl]piperazin-1-yl]methanone

Systemtic Name: (4-fluorophenyl)-[4-[(2-sulfanylidene-1H-pyridin-3-yl)carbonyl]piperazin-1-yl]methanone Openeye Name: (4-fluorophenyl)-[4-(2-thioxo-1H-pyridine-3-carbonyl)piperazin-1-yl]methanone CAS Name: (4-fluorophenyl)-[4-[oxo-(2-sulfanylidene-1H-pyridin-3-yl)methyl]-1-piperazinyl]methanone IUPAC Name: (4-fluorophenyl)-[4-(2-sulfanylidene-1H-pyridine-3-carbonyl)piperazin-1-yl]methanone Traditional Name: (4-fluorophenyl)-[4-(2-thioxo-1H-pyridine-3-carbonyl)piperazino]methanone Formula: C17H16FN3O2S MolecularWeight: 345.391243

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=C(C=C2)F)C(=O)C3=CC=CNC3=S

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=C(C=C2)F)C(=O)C3=CC=CNC3=S

InChI

InChI=1S/C17H16FN3O2S/c18-13-5-3-12(4-6-13)16(22)20-8-10-21(11-9-20)17(23)14-2-1-7-19-15(14)24/h1-7H,8-11H2,(H,19,24)