1-decylsulfanyl-4-ethynyl-2-fluoranyl-benzene

Systemtic Name: 1-decylsulfanyl-4-ethynyl-2-fluoranyl-benzene Openeye Name: 1-decylsulfanyl-4-ethynyl-2-fluoro-benzene CAS Name: 1-(decylthio)-4-ethynyl-2-fluorobenzene IUPAC Name: 1-decylsulfanyl-4-ethynyl-2-fluorobenzene Traditional Name: 1-(decylthio)-4-ethynyl-2-fluoro-benzene Formula: C18H25FS MolecularWeight: 292.454503

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCSC1=C(C=C(C=C1)C#C)F

Isomeric SMILES

CCCCCCCCCCSC1=C(C=C(C=C1)C#C)F

InChI

InChI=1S/C18H25FS/c1-3-5-6-7-8-9-10-11-14-20-18-13-12-16(4-2)15-17(18)19/h2,12-13,15H,3,5-11,14H2,1H3