6-pyridin-4-yl-9-[1-(pyridin-2-ylmethyl)piperidin-4-yl]-9H-thioxanthen-4-ol

Systemtic Name: 6-pyridin-4-yl-9-[1-(pyridin-2-ylmethyl)piperidin-4-yl]-9H-thioxanthen-4-ol Openeye Name: 6-(4-pyridyl)-9-[1-(2-pyridylmethyl)-4-piperidyl]-9H-thioxanthen-4-ol CAS Name: 6-pyridin-4-yl-9-[1-(2-pyridinylmethyl)-4-piperidinyl]-9H-thioxanthen-4-ol IUPAC Name: 6-pyridin-4-yl-9-[1-(pyridin-2-ylmethyl)piperidin-4-yl]-9H-thioxanthen-4-ol Traditional Name: 6-(4-pyridyl)-9-[1-(2-pyridylmethyl)-4-piperidyl]-9H-thioxanthen-4-ol Formula: C29H27N3OS MolecularWeight: 465.60918

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2C3=C(C(=CC=C3)O)SC4=C2C=CC(=C4)C5=CC=NC=C5)CC6=CC=CC=N6

Isomeric SMILES

C1CN(CCC1C2C3=C(C(=CC=C3)O)SC4=C2C=CC(=C4)C5=CC=NC=C5)CC6=CC=CC=N6

InChI

InChI=1S/C29H27N3OS/c33-26-6-3-5-25-28(21-11-16-32(17-12-21)19-23-4-1-2-13-31-23)24-8-7-22(18-27(24)34-29(25)26)20-9-14-30-15-10-20/h1-10,13-15,18,21,28,33H,11-12,16-17,19H2