(1S)-1-(3-bromophenyl)-4,4-bis(phenylsulfanyl)but-3-en-1-ol

Systemtic Name: (1S)-1-(3-bromophenyl)-4,4-bis(phenylsulfanyl)but-3-en-1-ol Openeye Name: (1S)-1-(3-bromophenyl)-4,4-bis(phenylsulfanyl)but-3-en-1-ol CAS Name: (1S)-1-(3-bromophenyl)-4,4-bis(phenylthio)-3-buten-1-ol IUPAC Name: (1S)-1-(3-bromophenyl)-4,4-bis(phenylsulfanyl)but-3-en-1-ol Traditional Name: (1S)-1-(3-bromophenyl)-4,4-bis(phenylthio)but-3-en-1-ol Formula: C22H19BrOS2 MolecularWeight: 443.41966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC(=CCC(C2=CC(=CC=C2)Br)O)SC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)SC(=CC[C@@H](C2=CC(=CC=C2)Br)O)SC3=CC=CC=C3

InChI

InChI=1S/C22H19BrOS2/c23-18-9-7-8-17(16-18)21(24)14-15-22(25-19-10-3-1-4-11-19)26-20-12-5-2-6-13-20/h1-13,15-16,21,24H,14H2/t21-/m0/s1