1-[2-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoyl]piperidine-4-carboxamide

Systemtic Name: 1-[2-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoyl]piperidine-4-carboxamide Openeye Name: 1-[2-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxo-1H-pyrimidin-6-yl]acetyl]piperidine-4-carboxamide CAS Name: 1-[2-[2-[(4-fluorophenyl)methylthio]-4-oxo-1H-pyrimidin-6-yl]-1-oxoethyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxo-1H-pyrimidin-6-yl]acetyl]piperidine-4-carboxamide Traditional Name: 1-[2-[2-[(4-fluorobenzyl)thio]-4-keto-1H-pyrimidin-6-yl]acetyl]isonipecotamide Formula: C19H21FN4O3S MolecularWeight: 404.458443

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N)C(=O)CC2=CC(=O)N=C(N2)SCC3=CC=C(C=C3)F

Isomeric SMILES

C1CN(CCC1C(=O)N)C(=O)CC2=CC(=O)N=C(N2)SCC3=CC=C(C=C3)F

InChI

InChI=1S/C19H21FN4O3S/c20-14-3-1-12(2-4-14)11-28-19-22-15(9-16(25)23-19)10-17(26)24-7-5-13(6-8-24)18(21)27/h1-4,9,13H,5-8,10-11H2,(H2,21,27)(H,22,23,25)