1-[4-(methylamino)phenyl]-2-(methylsulfanylmethyl)-3-phenyl-propane-1,3-dione

Systemtic Name: 1-[4-(methylamino)phenyl]-2-(methylsulfanylmethyl)-3-phenyl-propane-1,3-dione Openeye Name: 1-[4-(methylamino)phenyl]-2-(methylsulfanylmethyl)-3-phenyl-propane-1,3-dione CAS Name: 1-[4-(methylamino)phenyl]-2-[(methylthio)methyl]-3-phenylpropane-1,3-dione IUPAC Name: 1-[4-(methylamino)phenyl]-2-(methylsulfanylmethyl)-3-phenylpropane-1,3-dione Traditional Name: 1-[4-(methylamino)phenyl]-2-[(methylthio)methyl]-3-phenyl-propane-1,3-dione Formula: C18H19NO2S MolecularWeight: 313.41396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC1=CC=C(C=C1)C(=O)C(CSC)C(=O)C2=CC=CC=C2

Isomeric SMILES

CNC1=CC=C(C=C1)C(=O)C(CSC)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H19NO2S/c1-19-15-10-8-14(9-11-15)18(21)16(12-22-2)17(20)13-6-4-3-5-7-13/h3-11,16,19H,12H2,1-2H3