3-(3-pyridin-4-yl-9H-xanthen-9-yl)-8-(thiophen-2-ylmethyl)-8-azabicyclo[3.2.1]octane

Systemtic Name: 3-(3-pyridin-4-yl-9H-xanthen-9-yl)-8-(thiophen-2-ylmethyl)-8-azabicyclo[3.2.1]octane Openeye Name: 3-[3-(4-pyridyl)-9H-xanthen-9-yl]-8-(2-thienylmethyl)-8-azabicyclo[3.2.1]octane CAS Name: 3-(3-pyridin-4-yl-9H-xanthen-9-yl)-8-(thiophen-2-ylmethyl)-8-azabicyclo[3.2.1]octane IUPAC Name: 3-(3-pyridin-4-yl-9H-xanthen-9-yl)-8-(thiophen-2-ylmethyl)-8-azabicyclo[3.2.1]octane Traditional Name: 3-[3-(4-pyridyl)-9H-xanthen-9-yl]-8-(2-thenyl)-8-azabicyclo[3.2.1]octane Formula: C30H28N2OS MolecularWeight: 464.62112

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CC(CC1N2CC3=CC=CS3)C4C5=C(C=C(C=C5)C6=CC=NC=C6)OC7=CC=CC=C47

Isomeric SMILES

C1CC2CC(CC1N2CC3=CC=CS3)C4C5=C(C=C(C=C5)C6=CC=NC=C6)OC7=CC=CC=C47

InChI

InChI=1S/C30H28N2OS/c1-2-6-28-26(5-1)30(27-10-7-21(18-29(27)33-28)20-11-13-31-14-12-20)22-16-23-8-9-24(17-22)32(23)19-25-4-3-15-34-25/h1-7,10-15,18,22-24,30H,8-9,16-17,19H2