N-[[4-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-chloranyl-phenyl]carbamothioyl]-2-phenyl-ethanamide

Systemtic Name: N-[[4-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-chloranyl-phenyl]carbamothioyl]-2-phenyl-ethanamide Openeye Name: N-[[2-chloro-4-(1,3-dioxoisoindolin-2-yl)phenyl]carbamothioyl]-2-phenyl-acetamide CAS Name: N-[[2-chloro-4-(1,3-dioxo-2-isoindolyl)anilino]-sulfanylidenemethyl]-2-phenylacetamide IUPAC Name: N-[[2-chloro-4-(1,3-dioxoisoindol-2-yl)phenyl]carbamothioyl]-2-phenylacetamide Traditional Name: N-[(2-chloro-4-phthalimido-phenyl)thiocarbamoyl]-2-phenyl-acetamide Formula: C23H16ClN3O3S MolecularWeight: 449.90944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)NC(=S)NC2=C(C=C(C=C2)N3C(=O)C4=CC=CC=C4C3=O)Cl

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)NC(=S)NC2=C(C=C(C=C2)N3C(=O)C4=CC=CC=C4C3=O)Cl

InChI

InChI=1S/C23H16ClN3O3S/c24-18-13-15(27-21(29)16-8-4-5-9-17(16)22(27)30)10-11-19(18)25-23(31)26-20(28)12-14-6-2-1-3-7-14/h1-11,13H,12H2,(H2,25,26,28,31)