(4E)-4-[(4-chlorophenyl)methylidene]-2-propan-2-ylsulfanyl-1,3-oxazol-5-one

Systemtic Name: (4E)-4-[(4-chlorophenyl)methylidene]-2-propan-2-ylsulfanyl-1,3-oxazol-5-one Openeye Name: (4E)-4-[(4-chlorophenyl)methylene]-2-isopropylsulfanyl-oxazol-5-one CAS Name: (4E)-4-[(4-chlorophenyl)methylidene]-2-(propan-2-ylthio)-5-oxazolone IUPAC Name: (4E)-4-[(4-chlorophenyl)methylidene]-2-propan-2-ylsulfanyl-1,3-oxazol-5-one Traditional Name: (4E)-4-(4-chlorobenzylidene)-2-(isopropylthio)-2-oxazolin-5-one Formula: C13H12ClNO2S MolecularWeight: 281.75788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=NC(=CC2=CC=C(C=C2)Cl)C(=O)O1

Isomeric SMILES

CC(C)SC1=N/C(=C/C2=CC=C(C=C2)Cl)/C(=O)O1

InChI

InChI=1S/C13H12ClNO2S/c1-8(2)18-13-15-11(12(16)17-13)7-9-3-5-10(14)6-4-9/h3-8H,1-2H3/b11-7+