3-methyl-4,4,4-tris(phenylsulfanyl)butanal

Systemtic Name: 3-methyl-4,4,4-tris(phenylsulfanyl)butanal Openeye Name: 3-methyl-4,4,4-tris(phenylsulfanyl)butanal CAS Name: 3-methyl-4,4,4-tris(phenylthio)butanal IUPAC Name: 3-methyl-4,4,4-tris(phenylsulfanyl)butanal Traditional Name: 3-methyl-4,4,4-tris(phenylthio)butyraldehyde Formula: C23H22OS3 MolecularWeight: 410.61518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC=O)C(SC1=CC=CC=C1)(SC2=CC=CC=C2)SC3=CC=CC=C3

Isomeric SMILES

CC(CC=O)C(SC1=CC=CC=C1)(SC2=CC=CC=C2)SC3=CC=CC=C3

InChI

InChI=1S/C23H22OS3/c1-19(17-18-24)23(25-20-11-5-2-6-12-20,26-21-13-7-3-8-14-21)27-22-15-9-4-10-16-22/h2-16,18-19H,17H2,1H3