4-(1,3-dithian-2-yl)-1,1,1-triphenyl-pentan-2-one

Systemtic Name: 4-(1,3-dithian-2-yl)-1,1,1-triphenyl-pentan-2-one Openeye Name: 4-(1,3-dithian-2-yl)-1,1,1-triphenyl-pentan-2-one CAS Name: 4-(1,3-dithian-2-yl)-1,1,1-triphenyl-2-pentanone IUPAC Name: 4-(1,3-dithian-2-yl)-1,1,1-triphenylpentan-2-one Traditional Name: 4-(1,3-dithian-2-yl)-1,1,1-triphenyl-pentan-2-one Formula: C27H28OS2 MolecularWeight: 432.64062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)C4SCCCS4

Isomeric SMILES

CC(CC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)C4SCCCS4

InChI

InChI=1S/C27H28OS2/c1-21(26-29-18-11-19-30-26)20-25(28)27(22-12-5-2-6-13-22,23-14-7-3-8-15-23)24-16-9-4-10-17-24/h2-10,12-17,21,26H,11,18-20H2,1H3