3-bromanyl-N-[(4-methylphenyl)methylcarbamothioyl]-4-phenethyloxy-benzamide

Systemtic Name: 3-bromanyl-N-[(4-methylphenyl)methylcarbamothioyl]-4-phenethyloxy-benzamide Openeye Name: 3-bromo-4-phenethyloxy-N-(p-tolylmethylcarbamothioyl)benzamide CAS Name: 3-bromo-N-[[(4-methylphenyl)methylamino]-sulfanylidenemethyl]-4-phenethyloxybenzamide IUPAC Name: 3-bromo-N-[(4-methylphenyl)methylcarbamothioyl]-4-phenethyloxybenzamide Traditional Name: 3-bromo-N-[(4-methylbenzyl)thiocarbamoyl]-4-phenethyloxy-benzamide Formula: C24H23BrN2O2S MolecularWeight: 483.42062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=S)NC(=O)C2=CC(=C(C=C2)OCCC3=CC=CC=C3)Br

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=S)NC(=O)C2=CC(=C(C=C2)OCCC3=CC=CC=C3)Br

InChI

InChI=1S/C24H23BrN2O2S/c1-17-7-9-19(10-8-17)16-26-24(30)27-23(28)20-11-12-22(21(25)15-20)29-14-13-18-5-3-2-4-6-18/h2-12,15H,13-14,16H2,1H3,(H2,26,27,28,30)