1-(2-phenyl-1,3-dithian-2-yl)propan-2-one

Systemtic Name: 1-(2-phenyl-1,3-dithian-2-yl)propan-2-one Openeye Name: 1-(2-phenyl-1,3-dithian-2-yl)propan-2-one CAS Name: 1-(2-phenyl-1,3-dithian-2-yl)-2-propanone IUPAC Name: 1-(2-phenyl-1,3-dithian-2-yl)propan-2-one Traditional Name: 1-(2-phenyl-1,3-dithian-2-yl)acetone Formula: C13H16OS2 MolecularWeight: 252.39554

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC1(SCCCS1)C2=CC=CC=C2

Isomeric SMILES

CC(=O)CC1(SCCCS1)C2=CC=CC=C2

InChI

InChI=1S/C13H16OS2/c1-11(14)10-13(15-8-5-9-16-13)12-6-3-2-4-7-12/h2-4,6-7H,5,8-10H2,1H3