4-[2-ethynyl-3-(4-propylphenyl)phenyl]benzenethiol

Systemtic Name: 4-[2-ethynyl-3-(4-propylphenyl)phenyl]benzenethiol Openeye Name: 4-[2-ethynyl-3-(4-propylphenyl)phenyl]benzenethiol CAS Name: 4-[2-ethynyl-3-(4-propylphenyl)phenyl]benzenethiol IUPAC Name: 4-[2-ethynyl-3-(4-propylphenyl)phenyl]benzenethiol Traditional Name: 4-[2-ethynyl-3-(4-propylphenyl)phenyl]benzenethiol Formula: C23H20S MolecularWeight: 328.4699

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C2=C(C(=CC=C2)C3=CC=C(C=C3)S)C#C

Isomeric SMILES

CCCC1=CC=C(C=C1)C2=C(C(=CC=C2)C3=CC=C(C=C3)S)C#C

InChI

InChI=1S/C23H20S/c1-3-6-17-9-11-18(12-10-17)22-7-5-8-23(21(22)4-2)19-13-15-20(24)16-14-19/h2,5,7-16,24H,3,6H2,1H3