N-[(4-chloranyl-2-fluoranyl-phenyl)methylcarbamothioyl]-4-methyl-benzamide

Systemtic Name: N-[(4-chloranyl-2-fluoranyl-phenyl)methylcarbamothioyl]-4-methyl-benzamide Openeye Name: N-[(4-chloro-2-fluoro-phenyl)methylcarbamothioyl]-4-methyl-benzamide CAS Name: N-[[(4-chloro-2-fluorophenyl)methylamino]-sulfanylidenemethyl]-4-methylbenzamide IUPAC Name: N-[(4-chloro-2-fluorophenyl)methylcarbamothioyl]-4-methylbenzamide Traditional Name: N-[(4-chloro-2-fluoro-benzyl)thiocarbamoyl]-4-methyl-benzamide Formula: C16H14ClFN2OS MolecularWeight: 336.811563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(=S)NCC2=C(C=C(C=C2)Cl)F

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC(=S)NCC2=C(C=C(C=C2)Cl)F

InChI

InChI=1S/C16H14ClFN2OS/c1-10-2-4-11(5-3-10)15(21)20-16(22)19-9-12-6-7-13(17)8-14(12)18/h2-8H,9H2,1H3,(H2,19,20,21,22)