4-[2-(3,5-ditert-butyl-4-fluoranyl-phenyl)sulfanylethyl]pyridine

Systemtic Name: 4-[2-(3,5-ditert-butyl-4-fluoranyl-phenyl)sulfanylethyl]pyridine Openeye Name: 4-[2-(3,5-ditert-butyl-4-fluoro-phenyl)sulfanylethyl]pyridine CAS Name: 4-[2-[(3,5-ditert-butyl-4-fluorophenyl)thio]ethyl]pyridine IUPAC Name: 4-[2-(3,5-ditert-butyl-4-fluorophenyl)sulfanylethyl]pyridine Traditional Name: 4-[2-[(3,5-ditert-butyl-4-fluoro-phenyl)thio]ethyl]pyridine Formula: C21H28FNS MolecularWeight: 345.517123

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1F)C(C)(C)C)SCCC2=CC=NC=C2

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1F)C(C)(C)C)SCCC2=CC=NC=C2

InChI

InChI=1S/C21H28FNS/c1-20(2,3)17-13-16(14-18(19(17)22)21(4,5)6)24-12-9-15-7-10-23-11-8-15/h7-8,10-11,13-14H,9,12H2,1-6H3