N-[(4-bromanyl-2,6-dimethyl-phenyl)carbamothioyl]-3-phenylmethoxy-benzamide

Systemtic Name: N-[(4-bromanyl-2,6-dimethyl-phenyl)carbamothioyl]-3-phenylmethoxy-benzamide Openeye Name: 3-benzyloxy-N-[(4-bromo-2,6-dimethyl-phenyl)carbamothioyl]benzamide CAS Name: N-[(4-bromo-2,6-dimethylanilino)-sulfanylidenemethyl]-3-phenylmethoxybenzamide IUPAC Name: N-[(4-bromo-2,6-dimethylphenyl)carbamothioyl]-3-phenylmethoxybenzamide Traditional Name: 3-benzoxy-N-[(4-bromo-2,6-dimethyl-phenyl)thiocarbamoyl]benzamide Formula: C23H21BrN2O2S MolecularWeight: 469.39404

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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