2-[1-(4-chlorophenyl)hexadecylsulfanyl]pyridine

Systemtic Name: 2-[1-(4-chlorophenyl)hexadecylsulfanyl]pyridine Openeye Name: 2-[1-(4-chlorophenyl)hexadecylsulfanyl]pyridine CAS Name: 2-[1-(4-chlorophenyl)hexadecylthio]pyridine IUPAC Name: 2-[1-(4-chlorophenyl)hexadecylsulfanyl]pyridine Traditional Name: 2-[1-(4-chlorophenyl)hexadecylthio]pyridine Formula: C27H40ClNS MolecularWeight: 446.1312

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(C1=CC=C(C=C1)Cl)SC2=CC=CC=N2

Isomeric SMILES

CCCCCCCCCCCCCCCC(C1=CC=C(C=C1)Cl)SC2=CC=CC=N2

InChI

InChI=1S/C27H40ClNS/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-26(24-19-21-25(28)22-20-24)30-27-18-15-16-23-29-27/h15-16,18-23,26H,2-14,17H2,1H3