N-[[(3-chlorophenyl)carbonylamino]carbamothioyl]-4-phenyl-benzamide

Systemtic Name: N-[[(3-chlorophenyl)carbonylamino]carbamothioyl]-4-phenyl-benzamide Openeye Name: N-[[(3-chlorobenzoyl)amino]carbamothioyl]-4-phenyl-benzamide CAS Name: N-[[[(3-chlorophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-4-phenylbenzamide IUPAC Name: N-[[(3-chlorobenzoyl)amino]carbamothioyl]-4-phenylbenzamide Traditional Name: N-[[(3-chlorobenzoyl)amino]thiocarbamoyl]-4-phenyl-benzamide Formula: C21H16ClN3O2S MolecularWeight: 409.88864

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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=C3)Cl

Isomeric SMILES

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

InChI

InChI=1S/C21H16ClN3O2S/c22-18-8-4-7-17(13-18)20(27)24-25-21(28)23-19(26)16-11-9-15(10-12-16)14-5-2-1-3-6-14/h1-13H,(H,24,27)(H2,23,25,26,28)