ethyl (4Z)-1-(4-chlorophenyl)-2-methyl-4-[(4-methylsulfanylphenyl)methylidene]-5-oxidanylidene-pyrrole-3-carboxylate

Systemtic Name: ethyl (4Z)-1-(4-chlorophenyl)-2-methyl-4-[(4-methylsulfanylphenyl)methylidene]-5-oxidanylidene-pyrrole-3-carboxylate Openeye Name: ethyl (4Z)-1-(4-chlorophenyl)-2-methyl-4-[(4-methylsulfanylphenyl)methylene]-5-oxo-pyrrole-3-carboxylate CAS Name: (4Z)-1-(4-chlorophenyl)-2-methyl-4-[[4-(methylthio)phenyl]methylidene]-5-oxo-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl (4Z)-1-(4-chlorophenyl)-2-methyl-4-[(4-methylsulfanylphenyl)methylidene]-5-oxopyrrole-3-carboxylate Traditional Name: (4Z)-1-(4-chlorophenyl)-5-keto-2-methyl-4-[4-(methylthio)benzylidene]-2-pyrroline-3-carboxylic acid ethyl ester Formula: C22H20ClNO3S MolecularWeight: 413.9171

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)C1=CC2=CC=C(C=C2)SC)C3=CC=C(C=C3)Cl)C

Isomeric SMILES

CCOC(=O)C\1=C(N(C(=O)/C1=C\C2=CC=C(C=C2)SC)C3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C22H20ClNO3S/c1-4-27-22(26)20-14(2)24(17-9-7-16(23)8-10-17)21(25)19(20)13-15-5-11-18(28-3)12-6-15/h5-13H,4H2,1-3H3/b19-13-