S-methyl N-[4-bromanyl-2-(4-chlorophenyl)-3-cyano-5-(trifluoromethyl)pyrrol-1-yl]-N-methyl-carbamothioate

Systemtic Name: S-methyl N-[4-bromanyl-2-(4-chlorophenyl)-3-cyano-5-(trifluoromethyl)pyrrol-1-yl]-N-methyl-carbamothioate Openeye Name: S-methyl N-[4-bromo-2-(4-chlorophenyl)-3-cyano-5-(trifluoromethyl)pyrrol-1-yl]-N-methyl-carbamothioate CAS Name: N-[4-bromo-2-(4-chlorophenyl)-3-cyano-5-(trifluoromethyl)-1-pyrrolyl]-N-methylcarbamothioic acid S-methyl ester IUPAC Name: S-methyl N-[4-bromo-2-(4-chlorophenyl)-3-cyano-5-(trifluoromethyl)pyrrol-1-yl]-N-methylcarbamothioate Traditional Name: N-[4-bromo-2-(4-chlorophenyl)-3-cyano-5-(trifluoromethyl)pyrrol-1-yl]-N-methyl-thiocarbamic acid S-methyl ester Formula: C15H10BrClF3N3OS MolecularWeight: 452.67661

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C(=O)SC)N1C(=C(C(=C1C(F)(F)F)Br)C#N)C2=CC=C(C=C2)Cl

Isomeric SMILES

CN(C(=O)SC)N1C(=C(C(=C1C(F)(F)F)Br)C#N)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C15H10BrClF3N3OS/c1-22(14(24)25-2)23-12(8-3-5-9(17)6-4-8)10(7-21)11(16)13(23)15(18,19)20/h3-6H,1-2H3