N-[[4-[1,3-bis(oxidanylidene)isoindol-2-yl]phenyl]carbamothioyl]-3-bromanyl-4-ethoxy-benzamide

Systemtic Name: N-[[4-[1,3-bis(oxidanylidene)isoindol-2-yl]phenyl]carbamothioyl]-3-bromanyl-4-ethoxy-benzamide Openeye Name: 3-bromo-N-[[4-(1,3-dioxoisoindolin-2-yl)phenyl]carbamothioyl]-4-ethoxy-benzamide CAS Name: 3-bromo-N-[[4-(1,3-dioxo-2-isoindolyl)anilino]-sulfanylidenemethyl]-4-ethoxybenzamide IUPAC Name: 3-bromo-N-[[4-(1,3-dioxoisoindol-2-yl)phenyl]carbamothioyl]-4-ethoxybenzamide Traditional Name: 3-bromo-4-ethoxy-N-[(4-phthalimidophenyl)thiocarbamoyl]benzamide Formula: C24H18BrN3O4S MolecularWeight: 524.38642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4C3=O)Br

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4C3=O)Br

InChI

InChI=1S/C24H18BrN3O4S/c1-2-32-20-12-7-14(13-19(20)25)21(29)27-24(33)26-15-8-10-16(11-9-15)28-22(30)17-5-3-4-6-18(17)23(28)31/h3-13H,2H2,1H3,(H2,26,27,29,33)