N-[2,5-bis(fluoranyl)phenyl]-1-(3-phenylsulfanylpyrazin-2-yl)piperidine-4-carboxamide

Systemtic Name: N-[2,5-bis(fluoranyl)phenyl]-1-(3-phenylsulfanylpyrazin-2-yl)piperidine-4-carboxamide Openeye Name: N-(2,5-difluorophenyl)-1-(3-phenylsulfanylpyrazin-2-yl)piperidine-4-carboxamide CAS Name: N-(2,5-difluorophenyl)-1-[3-(phenylthio)-2-pyrazinyl]-4-piperidinecarboxamide IUPAC Name: N-(2,5-difluorophenyl)-1-(3-phenylsulfanylpyrazin-2-yl)piperidine-4-carboxamide Traditional Name: N-(2,5-difluorophenyl)-1-[3-(phenylthio)pyrazin-2-yl]isonipecotamide Formula: C22H20F2N4OS MolecularWeight: 426.482206

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=C(C=CC(=C2)F)F)C3=NC=CN=C3SC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)NC2=C(C=CC(=C2)F)F)C3=NC=CN=C3SC4=CC=CC=C4

InChI

InChI=1S/C22H20F2N4OS/c23-16-6-7-18(24)19(14-16)27-21(29)15-8-12-28(13-9-15)20-22(26-11-10-25-20)30-17-4-2-1-3-5-17/h1-7,10-11,14-15H,8-9,12-13H2,(H,27,29)