N-[[(2-bromophenyl)carbonylamino]carbamothioyl]-4-phenyl-benzamide

Systemtic Name: N-[[(2-bromophenyl)carbonylamino]carbamothioyl]-4-phenyl-benzamide Openeye Name: N-[[(2-bromobenzoyl)amino]carbamothioyl]-4-phenyl-benzamide CAS Name: N-[[[(2-bromophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-4-phenylbenzamide IUPAC Name: N-[[(2-bromobenzoyl)amino]carbamothioyl]-4-phenylbenzamide Traditional Name: N-[[(2-bromobenzoyl)amino]thiocarbamoyl]-4-phenyl-benzamide Formula: C21H16BrN3O2S MolecularWeight: 454.33964

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)NC(=S)NNC(=O)C3=CC=CC=C3Br

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)NC(=S)NNC(=O)C3=CC=CC=C3Br

InChI

InChI=1S/C21H16BrN3O2S/c22-18-9-5-4-8-17(18)20(27)24-25-21(28)23-19(26)16-12-10-15(11-13-16)14-6-2-1-3-7-14/h1-13H,(H,24,27)(H2,23,25,26,28)