3,5-bis(4-bromophenyl)-1,6-diphenyl-4-thiabicyclo[3.1.0]hex-2-ene

Systemtic Name: 3,5-bis(4-bromophenyl)-1,6-diphenyl-4-thiabicyclo[3.1.0]hex-2-ene Openeye Name: 3,5-bis(4-bromophenyl)-1,6-diphenyl-4-thiabicyclo[3.1.0]hex-2-ene CAS Name: 3,5-bis(4-bromophenyl)-1,6-diphenyl-4-thiabicyclo[3.1.0]hex-2-ene IUPAC Name: 3,5-bis(4-bromophenyl)-1,6-diphenyl-4-thiabicyclo[3.1.0]hex-2-ene Traditional Name: 3,5-bis(4-bromophenyl)-1,6-diphenyl-4-thiabicyclo[3.1.0]hex-2-ene Formula: C29H20Br2S MolecularWeight: 560.3421

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2C3(C2(SC(=C3)C4=CC=C(C=C4)Br)C5=CC=C(C=C5)Br)C6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)C2C3(C2(SC(=C3)C4=CC=C(C=C4)Br)C5=CC=C(C=C5)Br)C6=CC=CC=C6

InChI

InChI=1S/C29H20Br2S/c30-24-15-11-20(12-16-24)26-19-28(22-9-5-2-6-10-22)27(21-7-3-1-4-8-21)29(28,32-26)23-13-17-25(31)18-14-23/h1-19,27H