2-(4-chlorophenyl)-N-[(2-cyanophenyl)carbamothioyl]ethanamide

Systemtic Name: 2-(4-chlorophenyl)-N-[(2-cyanophenyl)carbamothioyl]ethanamide Openeye Name: 2-(4-chlorophenyl)-N-[(2-cyanophenyl)carbamothioyl]acetamide CAS Name: 2-(4-chlorophenyl)-N-[(2-cyanoanilino)-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-chlorophenyl)-N-[(2-cyanophenyl)carbamothioyl]acetamide Traditional Name: 2-(4-chlorophenyl)-N-[(2-cyanophenyl)thiocarbamoyl]acetamide Formula: C16H12ClN3OS MolecularWeight: 329.80398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#N)NC(=S)NC(=O)CC2=CC=C(C=C2)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C#N)NC(=S)NC(=O)CC2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H12ClN3OS/c17-13-7-5-11(6-8-13)9-15(21)20-16(22)19-14-4-2-1-3-12(14)10-18/h1-8H,9H2,(H2,19,20,21,22)