3-bromanyl-N-[(2,3-dimethylphenyl)carbamothioyl]-4-phenethyloxy-benzamide

Systemtic Name: 3-bromanyl-N-[(2,3-dimethylphenyl)carbamothioyl]-4-phenethyloxy-benzamide Openeye Name: 3-bromo-N-[(2,3-dimethylphenyl)carbamothioyl]-4-phenethyloxy-benzamide CAS Name: 3-bromo-N-[(2,3-dimethylanilino)-sulfanylidenemethyl]-4-phenethyloxybenzamide IUPAC Name: 3-bromo-N-[(2,3-dimethylphenyl)carbamothioyl]-4-phenethyloxybenzamide Traditional Name: 3-bromo-N-[(2,3-dimethylphenyl)thiocarbamoyl]-4-phenethyloxy-benzamide Formula: C24H23BrN2O2S MolecularWeight: 483.42062

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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