N-[(4-aminocarbonylphenyl)carbamothioyl]-3-bromanyl-4-phenethyloxy-benzamide

Systemtic Name: N-[(4-aminocarbonylphenyl)carbamothioyl]-3-bromanyl-4-phenethyloxy-benzamide Openeye Name: 3-bromo-N-[(4-carbamoylphenyl)carbamothioyl]-4-phenethyloxy-benzamide CAS Name: 3-bromo-N-[(4-carbamoylanilino)-sulfanylidenemethyl]-4-phenethyloxybenzamide IUPAC Name: 3-bromo-N-[(4-carbamoylphenyl)carbamothioyl]-4-phenethyloxybenzamide Traditional Name: 3-bromo-N-[(4-carbamoylphenyl)thiocarbamoyl]-4-phenethyloxy-benzamide Formula: C23H20BrN3O3S MolecularWeight: 498.3922

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCOC2=C(C=C(C=C2)C(=O)NC(=S)NC3=CC=C(C=C3)C(=O)N)Br

Isomeric SMILES

C1=CC=C(C=C1)CCOC2=C(C=C(C=C2)C(=O)NC(=S)NC3=CC=C(C=C3)C(=O)N)Br

InChI

InChI=1S/C23H20BrN3O3S/c24-19-14-17(8-11-20(19)30-13-12-15-4-2-1-3-5-15)22(29)27-23(31)26-18-9-6-16(7-10-18)21(25)28/h1-11,14H,12-13H2,(H2,25,28)(H2,26,27,29,31)