1,3,4-triphenylbenzo[f][2]benzothiole

Systemtic Name: 1,3,4-triphenylbenzo[f][2]benzothiole Openeye Name: 1,3,4-triphenylbenzo[f][2]benzothiole CAS Name: 1,3,4-triphenylbenzo[f][2]benzothiole IUPAC Name: 1,3,4-triphenylbenzo[f][2]benzothiole Traditional Name: 1,3,4-triphenylbenz[f]isobenzothiophene Formula: C30H20S MolecularWeight: 412.5448

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C=CC=CC3=CC4=C(SC(=C42)C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C=CC=CC3=CC4=C(SC(=C42)C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C30H20S/c1-4-12-21(13-5-1)27-25-19-11-10-18-24(25)20-26-28(27)30(23-16-8-3-9-17-23)31-29(26)22-14-6-2-7-15-22/h1-20H