8-methyl-3-(3-pyridin-3-ylthioxanthen-9-ylidene)-8-azabicyclo[3.2.1]octane

Systemtic Name: 8-methyl-3-(3-pyridin-3-ylthioxanthen-9-ylidene)-8-azabicyclo[3.2.1]octane Openeye Name: 8-methyl-3-[3-(3-pyridyl)thioxanthen-9-ylidene]-8-azabicyclo[3.2.1]octane CAS Name: 8-methyl-3-[3-(3-pyridinyl)-9-thioxanthenylidene]-8-azabicyclo[3.2.1]octane IUPAC Name: 8-methyl-3-(3-pyridin-3-ylthioxanthen-9-ylidene)-8-azabicyclo[3.2.1]octane Traditional Name: 8-methyl-3-[3-(3-pyridyl)thioxanthen-9-ylidene]-8-azabicyclo[3.2.1]octane Formula: C26H24N2S MolecularWeight: 396.54716

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2CCC1CC(=C3C4=C(C=C(C=C4)C5=CN=CC=C5)SC6=CC=CC=C63)C2

Isomeric SMILES

CN1C2CCC1CC(=C3C4=C(C=C(C=C4)C5=CN=CC=C5)SC6=CC=CC=C63)C2

InChI

InChI=1S/C26H24N2S/c1-28-20-9-10-21(28)14-19(13-20)26-22-6-2-3-7-24(22)29-25-15-17(8-11-23(25)26)18-5-4-12-27-16-18/h2-8,11-12,15-16,20-21H,9-10,13-14H2,1H3