(2-sulfanylidenepyridin-1-yl) 3-methyl-2-phenyl-but-2-enoate

Systemtic Name: (2-sulfanylidenepyridin-1-yl) 3-methyl-2-phenyl-but-2-enoate Openeye Name: (2-thioxo-1-pyridyl) 3-methyl-2-phenyl-but-2-enoate CAS Name: 3-methyl-2-phenyl-2-butenoic acid (2-sulfanylidene-1-pyridinyl) ester IUPAC Name: (2-sulfanylidenepyridin-1-yl) 3-methyl-2-phenylbut-2-enoate Traditional Name: 3-methyl-2-phenyl-but-2-enoic acid (2-thioxo-1-pyridyl) ester Formula: C16H15NO2S MolecularWeight: 285.3608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C1=CC=CC=C1)C(=O)ON2C=CC=CC2=S)C

Isomeric SMILES

CC(=C(C1=CC=CC=C1)C(=O)ON2C=CC=CC2=S)C

InChI

InChI=1S/C16H15NO2S/c1-12(2)15(13-8-4-3-5-9-13)16(18)19-17-11-7-6-10-14(17)20/h3-11H,1-2H3