N-[(E)-1-quinolin-8-ylethylideneamino]-3-azabicyclo[3.2.2]nonane-3-carbothioamide

Systemtic Name: N-[(E)-1-quinolin-8-ylethylideneamino]-3-azabicyclo[3.2.2]nonane-3-carbothioamide Openeye Name: N-[(E)-1-(8-quinolyl)ethylideneamino]-3-azabicyclo[3.2.2]nonane-3-carbothioamide CAS Name: N-[(E)-1-(8-quinolinyl)ethylideneamino]-3-azabicyclo[3.2.2]nonane-3-carbothioamide IUPAC Name: N-[(E)-1-quinolin-8-ylethylideneamino]-3-azabicyclo[3.2.2]nonane-3-carbothioamide Traditional Name: N-[(E)-1-(8-quinolyl)ethylideneamino]-3-azabicyclo[3.2.2]nonane-3-carbothioamide Formula: C20H24N4S MolecularWeight: 352.49636

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)N1CC2CCC(C1)CC2)C3=CC=CC4=C3N=CC=C4

Isomeric SMILES

C/C(=N\NC(=S)N1CC2CCC(C1)CC2)/C3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C20H24N4S/c1-14(18-6-2-4-17-5-3-11-21-19(17)18)22-23-20(25)24-12-15-7-8-16(13-24)10-9-15/h2-6,11,15-16H,7-10,12-13H2,1H3,(H,23,25)/b22-14+