N-[(4-bromanyl-2,6-dimethyl-phenyl)carbamothioyl]-4-phenylmethoxy-benzamide

Systemtic Name: N-[(4-bromanyl-2,6-dimethyl-phenyl)carbamothioyl]-4-phenylmethoxy-benzamide Openeye Name: 4-benzyloxy-N-[(4-bromo-2,6-dimethyl-phenyl)carbamothioyl]benzamide CAS Name: N-[(4-bromo-2,6-dimethylanilino)-sulfanylidenemethyl]-4-phenylmethoxybenzamide IUPAC Name: N-[(4-bromo-2,6-dimethylphenyl)carbamothioyl]-4-phenylmethoxybenzamide Traditional Name: 4-benzoxy-N-[(4-bromo-2,6-dimethyl-phenyl)thiocarbamoyl]benzamide Formula: C23H21BrN2O2S MolecularWeight: 469.39404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1NC(=S)NC(=O)C2=CC=C(C=C2)OCC3=CC=CC=C3)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1NC(=S)NC(=O)C2=CC=C(C=C2)OCC3=CC=CC=C3)C)Br

InChI

InChI=1S/C23H21BrN2O2S/c1-15-12-19(24)13-16(2)21(15)25-23(29)26-22(27)18-8-10-20(11-9-18)28-14-17-6-4-3-5-7-17/h3-13H,14H2,1-2H3,(H2,25,26,27,29)