2-[1-(4-phenoxyphenyl)octylsulfanyl]pyridine

Systemtic Name: 2-[1-(4-phenoxyphenyl)octylsulfanyl]pyridine Openeye Name: 2-[1-(4-phenoxyphenyl)octylsulfanyl]pyridine CAS Name: 2-[1-(4-phenoxyphenyl)octylthio]pyridine IUPAC Name: 2-[1-(4-phenoxyphenyl)octylsulfanyl]pyridine Traditional Name: 2-[1-(4-phenoxyphenyl)octylthio]pyridine Formula: C25H29NOS MolecularWeight: 391.56886

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(C1=CC=C(C=C1)OC2=CC=CC=C2)SC3=CC=CC=N3

Isomeric SMILES

CCCCCCCC(C1=CC=C(C=C1)OC2=CC=CC=C2)SC3=CC=CC=N3

InChI

InChI=1S/C25H29NOS/c1-2-3-4-5-9-14-24(28-25-15-10-11-20-26-25)21-16-18-23(19-17-21)27-22-12-7-6-8-13-22/h6-8,10-13,15-20,24H,2-5,9,14H2,1H3