2-[2-(4-bromophenyl)ethynyl]-1-benzothiophene

Systemtic Name: 2-[2-(4-bromophenyl)ethynyl]-1-benzothiophene Openeye Name: 2-[2-(4-bromophenyl)ethynyl]benzothiophene CAS Name: 2-[2-(4-bromophenyl)ethynyl]-1-benzothiophene IUPAC Name: 2-[2-(4-bromophenyl)ethynyl]-1-benzothiophene Traditional Name: 2-[2-(4-bromophenyl)ethynyl]benzothiophene Formula: C16H9BrS MolecularWeight: 313.21166

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(S2)C#CC3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C2C(=C1)C=C(S2)C#CC3=CC=C(C=C3)Br

InChI

InChI=1S/C16H9BrS/c17-14-8-5-12(6-9-14)7-10-15-11-13-3-1-2-4-16(13)18-15/h1-6,8-9,11H