9-[2-(5-piperidin-1-ylpent-3-ynyl)-1,3-dithian-2-yl]thioxanthen-9-ol

Systemtic Name: 9-[2-(5-piperidin-1-ylpent-3-ynyl)-1,3-dithian-2-yl]thioxanthen-9-ol Openeye Name: 9-[2-[5-(1-piperidyl)pent-3-ynyl]-1,3-dithian-2-yl]thioxanthen-9-ol CAS Name: 9-[2-[5-(1-piperidinyl)pent-3-ynyl]-1,3-dithian-2-yl]-9-thioxanthenol IUPAC Name: 9-[2-(5-piperidin-1-ylpent-3-ynyl)-1,3-dithian-2-yl]thioxanthen-9-ol Traditional Name: 9-[2-(5-piperidinopent-3-ynyl)-1,3-dithian-2-yl]thioxanthen-9-ol Formula: C27H31NOS3 MolecularWeight: 481.73614

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC#CCCC2(SCCCS2)C3(C4=CC=CC=C4SC5=CC=CC=C53)O

Isomeric SMILES

C1CCN(CC1)CC#CCCC2(SCCCS2)C3(C4=CC=CC=C4SC5=CC=CC=C53)O

InChI

InChI=1S/C27H31NOS3/c29-27(22-12-3-5-14-24(22)32-25-15-6-4-13-23(25)27)26(30-20-11-21-31-26)16-7-1-8-17-28-18-9-2-10-19-28/h3-6,12-15,29H,2,7,9-11,16-21H2