6-pyridin-3-yl-9-[1-(thiophen-2-ylmethyl)piperidin-4-yl]-9H-xanthen-4-ol

Systemtic Name: 6-pyridin-3-yl-9-[1-(thiophen-2-ylmethyl)piperidin-4-yl]-9H-xanthen-4-ol Openeye Name: 6-(3-pyridyl)-9-[1-(2-thienylmethyl)-4-piperidyl]-9H-xanthen-4-ol CAS Name: 6-(3-pyridinyl)-9-[1-(thiophen-2-ylmethyl)-4-piperidinyl]-9H-xanthen-4-ol IUPAC Name: 6-pyridin-3-yl-9-[1-(thiophen-2-ylmethyl)piperidin-4-yl]-9H-xanthen-4-ol Traditional Name: 6-(3-pyridyl)-9-[1-(2-thenyl)-4-piperidyl]-9H-xanthen-4-ol Formula: C28H26N2O2S MolecularWeight: 454.58324

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2C3=C(C(=CC=C3)O)OC4=C2C=CC(=C4)C5=CN=CC=C5)CC6=CC=CS6

Isomeric SMILES

C1CN(CCC1C2C3=C(C(=CC=C3)O)OC4=C2C=CC(=C4)C5=CN=CC=C5)CC6=CC=CS6

InChI

InChI=1S/C28H26N2O2S/c31-25-7-1-6-24-27(19-10-13-30(14-11-19)18-22-5-3-15-33-22)23-9-8-20(16-26(23)32-28(24)25)21-4-2-12-29-17-21/h1-9,12,15-17,19,27,31H,10-11,13-14,18H2