2-[(4-bromophenyl)carbamothioylamino]-2-phenyl-N-[4-(2-sulfamoylphenyl)phenyl]ethanamide

Systemtic Name: 2-[(4-bromophenyl)carbamothioylamino]-2-phenyl-N-[4-(2-sulfamoylphenyl)phenyl]ethanamide Openeye Name: 2-[(4-bromophenyl)carbamothioylamino]-2-phenyl-N-[4-(2-sulfamoylphenyl)phenyl]acetamide CAS Name: 2-[[(4-bromoanilino)-sulfanylidenemethyl]amino]-2-phenyl-N-[4-(2-sulfamoylphenyl)phenyl]acetamide IUPAC Name: 2-[(4-bromophenyl)carbamothioylamino]-2-phenyl-N-[4-(2-sulfamoylphenyl)phenyl]acetamide Traditional Name: 2-[(4-bromophenyl)thiocarbamoylamino]-2-phenyl-N-[4-(2-sulfamoylphenyl)phenyl]acetamide Formula: C27H23BrN4O3S2 MolecularWeight: 595.53052

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)NC2=CC=C(C=C2)C3=CC=CC=C3S(=O)(=O)N)NC(=S)NC4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)NC2=CC=C(C=C2)C3=CC=CC=C3S(=O)(=O)N)NC(=S)NC4=CC=C(C=C4)Br

InChI

InChI=1S/C27H23BrN4O3S2/c28-20-12-16-22(17-13-20)31-27(36)32-25(19-6-2-1-3-7-19)26(33)30-21-14-10-18(11-15-21)23-8-4-5-9-24(23)37(29,34)35/h1-17,25H,(H,30,33)(H2,29,34,35)(H2,31,32,36)