2-[[9-(pyridin-2-ylmethyl)thioxanthen-9-yl]methyl]pyridine

Systemtic Name: 2-[[9-(pyridin-2-ylmethyl)thioxanthen-9-yl]methyl]pyridine Openeye Name: 2-[[9-(2-pyridylmethyl)thioxanthen-9-yl]methyl]pyridine CAS Name: 2-[[9-(2-pyridinylmethyl)-9-thioxanthenyl]methyl]pyridine IUPAC Name: 2-[[9-(pyridin-2-ylmethyl)thioxanthen-9-yl]methyl]pyridine Traditional Name: 2-[[9-(2-pyridylmethyl)thioxanthen-9-yl]methyl]pyridine Formula: C25H20N2S MolecularWeight: 380.5047

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C3=CC=CC=C3S2)(CC4=CC=CC=N4)CC5=CC=CC=N5

Isomeric SMILES

C1=CC=C2C(=C1)C(C3=CC=CC=C3S2)(CC4=CC=CC=N4)CC5=CC=CC=N5

InChI

InChI=1S/C25H20N2S/c1-3-13-23-21(11-1)25(17-19-9-5-7-15-26-19,18-20-10-6-8-16-27-20)22-12-2-4-14-24(22)28-23/h1-16H,17-18H2