4,4-dimethyl-2-(4-methylsulfanylphenyl)-3-phenyl-cyclobut-2-en-1-one

Systemtic Name: 4,4-dimethyl-2-(4-methylsulfanylphenyl)-3-phenyl-cyclobut-2-en-1-one Openeye Name: 4,4-dimethyl-2-(4-methylsulfanylphenyl)-3-phenyl-cyclobut-2-en-1-one CAS Name: 4,4-dimethyl-2-[4-(methylthio)phenyl]-3-phenyl-1-cyclobut-2-enone IUPAC Name: 4,4-dimethyl-2-(4-methylsulfanylphenyl)-3-phenylcyclobut-2-en-1-one Traditional Name: 4,4-dimethyl-2-[4-(methylthio)phenyl]-3-phenyl-cyclobut-2-en-1-one Formula: C19H18OS MolecularWeight: 294.41062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=C(C1=O)C2=CC=C(C=C2)SC)C3=CC=CC=C3)C

Isomeric SMILES

CC1(C(=C(C1=O)C2=CC=C(C=C2)SC)C3=CC=CC=C3)C

InChI

InChI=1S/C19H18OS/c1-19(2)17(14-7-5-4-6-8-14)16(18(19)20)13-9-11-15(21-3)12-10-13/h4-12H,1-3H3