(E)-1-(4-methoxyphenyl)-3-phenyl-3-(phenylmethylsulfanyl)prop-2-en-1-one

Systemtic Name: (E)-1-(4-methoxyphenyl)-3-phenyl-3-(phenylmethylsulfanyl)prop-2-en-1-one Openeye Name: (E)-3-benzylsulfanyl-1-(4-methoxyphenyl)-3-phenyl-prop-2-en-1-one CAS Name: (E)-1-(4-methoxyphenyl)-3-phenyl-3-(phenylmethylthio)-2-propen-1-one IUPAC Name: (E)-3-benzylsulfanyl-1-(4-methoxyphenyl)-3-phenylprop-2-en-1-one Traditional Name: (E)-3-(benzylthio)-1-(4-methoxyphenyl)-3-phenyl-prop-2-en-1-one Formula: C23H20O2S MolecularWeight: 360.4687

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C=C(C2=CC=CC=C2)SCC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)/C=C(\C2=CC=CC=C2)/SCC3=CC=CC=C3

InChI

InChI=1S/C23H20O2S/c1-25-21-14-12-19(13-15-21)22(24)16-23(20-10-6-3-7-11-20)26-17-18-8-4-2-5-9-18/h2-16H,17H2,1H3/b23-16+