4,4,4-tris(phenylsulfanyl)butanal

Systemtic Name: 4,4,4-tris(phenylsulfanyl)butanal Openeye Name: 4,4,4-tris(phenylsulfanyl)butanal CAS Name: 4,4,4-tris(phenylthio)butanal IUPAC Name: 4,4,4-tris(phenylsulfanyl)butanal Traditional Name: 4,4,4-tris(phenylthio)butyraldehyde Formula: C22H20OS3 MolecularWeight: 396.5886

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC(CCC=O)(SC2=CC=CC=C2)SC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)SC(CCC=O)(SC2=CC=CC=C2)SC3=CC=CC=C3

InChI

InChI=1S/C22H20OS3/c23-18-10-17-22(24-19-11-4-1-5-12-19,25-20-13-6-2-7-14-20)26-21-15-8-3-9-16-21/h1-9,11-16,18H,10,17H2