5-bromanyl-N-[(2,6-dimethylphenyl)carbamothioyl]-2-phenethyloxy-benzamide

Systemtic Name: 5-bromanyl-N-[(2,6-dimethylphenyl)carbamothioyl]-2-phenethyloxy-benzamide Openeye Name: 5-bromo-N-[(2,6-dimethylphenyl)carbamothioyl]-2-phenethyloxy-benzamide CAS Name: 5-bromo-N-[(2,6-dimethylanilino)-sulfanylidenemethyl]-2-phenethyloxybenzamide IUPAC Name: 5-bromo-N-[(2,6-dimethylphenyl)carbamothioyl]-2-phenethyloxybenzamide Traditional Name: 5-bromo-N-[(2,6-dimethylphenyl)thiocarbamoyl]-2-phenethyloxy-benzamide Formula: C24H23BrN2O2S MolecularWeight: 483.42062

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H23BrN2O2S/c1-16-7-6-8-17(2)22(16)26-24(30)27-23(28)20-15-19(25)11-12-21(20)29-14-13-18-9-4-3-5-10-18/h3-12,15H,13-14H2,1-2H3,(H2,26,27,28,30)