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

Systemtic Name: 5-bromanyl-N-[(2,5-dimethoxyphenyl)carbamothioyl]-2-phenethyloxy-benzamide Openeye Name: 5-bromo-N-[(2,5-dimethoxyphenyl)carbamothioyl]-2-phenethyloxy-benzamide CAS Name: 5-bromo-N-[(2,5-dimethoxyanilino)-sulfanylidenemethyl]-2-phenethyloxybenzamide IUPAC Name: 5-bromo-N-[(2,5-dimethoxyphenyl)carbamothioyl]-2-phenethyloxybenzamide Traditional Name: 5-bromo-N-[(2,5-dimethoxyphenyl)thiocarbamoyl]-2-phenethyloxy-benzamide Formula: C24H23BrN2O4S MolecularWeight: 515.41942

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)NC(=S)NC(=O)C2=C(C=CC(=C2)Br)OCCC3=CC=CC=C3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)NC(=S)NC(=O)C2=C(C=CC(=C2)Br)OCCC3=CC=CC=C3

InChI

InChI=1S/C24H23BrN2O4S/c1-29-18-9-11-22(30-2)20(15-18)26-24(32)27-23(28)19-14-17(25)8-10-21(19)31-13-12-16-6-4-3-5-7-16/h3-11,14-15H,12-13H2,1-2H3,(H2,26,27,28,32)