4-[2-[[3-(trifluoromethylsulfanyl)phenyl]methyl]-1,2-diazinan-1-yl]naphthalene-1-carbonitrile

Systemtic Name: 4-[2-[[3-(trifluoromethylsulfanyl)phenyl]methyl]-1,2-diazinan-1-yl]naphthalene-1-carbonitrile Openeye Name: 4-[2-[[3-(trifluoromethylsulfanyl)phenyl]methyl]hexahydropyridazin-1-yl]naphthalene-1-carbonitrile CAS Name: 4-[2-[[3-(trifluoromethylthio)phenyl]methyl]-1-diazinanyl]-1-naphthalenecarbonitrile IUPAC Name: 4-[2-[[3-(trifluoromethylsulfanyl)phenyl]methyl]diazinan-1-yl]naphthalene-1-carbonitrile Traditional Name: 4-[2-[3-(trifluoromethylthio)benzyl]hexahydropyridazin-1-yl]naphthalene-1-carbonitrile Formula: C23H20F3N3S MolecularWeight: 427.48521

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(N(C1)CC2=CC(=CC=C2)SC(F)(F)F)C3=CC=C(C4=CC=CC=C43)C#N

Isomeric SMILES

C1CCN(N(C1)CC2=CC(=CC=C2)SC(F)(F)F)C3=CC=C(C4=CC=CC=C43)C#N

InChI

InChI=1S/C23H20F3N3S/c24-23(25,26)30-19-7-5-6-17(14-19)16-28-12-3-4-13-29(28)22-11-10-18(15-27)20-8-1-2-9-21(20)22/h1-2,5-11,14H,3-4,12-13,16H2