methyl (4Z)-1-(3-chloranyl-4-fluoranyl-phenyl)-2-methyl-4-[(4-methylsulfanylphenyl)methylidene]-5-oxidanylidene-pyrrole-3-carboxylate

Systemtic Name: methyl (4Z)-1-(3-chloranyl-4-fluoranyl-phenyl)-2-methyl-4-[(4-methylsulfanylphenyl)methylidene]-5-oxidanylidene-pyrrole-3-carboxylate Openeye Name: methyl (4Z)-1-(3-chloro-4-fluoro-phenyl)-2-methyl-4-[(4-methylsulfanylphenyl)methylene]-5-oxo-pyrrole-3-carboxylate CAS Name: (4Z)-1-(3-chloro-4-fluorophenyl)-2-methyl-4-[[4-(methylthio)phenyl]methylidene]-5-oxo-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl (4Z)-1-(3-chloro-4-fluorophenyl)-2-methyl-4-[(4-methylsulfanylphenyl)methylidene]-5-oxopyrrole-3-carboxylate Traditional Name: (4Z)-1-(3-chloro-4-fluoro-phenyl)-5-keto-2-methyl-4-[4-(methylthio)benzylidene]-2-pyrroline-3-carboxylic acid methyl ester Formula: C21H17ClFNO3S MolecularWeight: 417.880983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC2=CC=C(C=C2)SC)C(=O)N1C3=CC(=C(C=C3)F)Cl)C(=O)OC

Isomeric SMILES

CC1=C(/C(=C/C2=CC=C(C=C2)SC)/C(=O)N1C3=CC(=C(C=C3)F)Cl)C(=O)OC

InChI

InChI=1S/C21H17ClFNO3S/c1-12-19(21(26)27-2)16(10-13-4-7-15(28-3)8-5-13)20(25)24(12)14-6-9-18(23)17(22)11-14/h4-11H,1-3H3/b16-10-