(4-fluorophenyl)-(4-heptoxyphenyl)methanethiol

Systemtic Name: (4-fluorophenyl)-(4-heptoxyphenyl)methanethiol Openeye Name: (4-fluorophenyl)-(4-heptoxyphenyl)methanethiol CAS Name: (4-fluorophenyl)-(4-heptoxyphenyl)methanethiol IUPAC Name: (4-fluorophenyl)-(4-heptoxyphenyl)methanethiol Traditional Name: (4-fluorophenyl)-(4-heptoxyphenyl)methanethiol Formula: C20H25FOS MolecularWeight: 332.475303

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C(C2=CC=C(C=C2)F)S

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C(C2=CC=C(C=C2)F)S

InChI

InChI=1S/C20H25FOS/c1-2-3-4-5-6-15-22-19-13-9-17(10-14-19)20(23)16-7-11-18(21)12-8-16/h7-14,20,23H,2-6,15H2,1H3