4-chloranyl-N-[[3-(3-phenylpropanoylamino)phenyl]carbamothioyl]benzamide

Systemtic Name: 4-chloranyl-N-[[3-(3-phenylpropanoylamino)phenyl]carbamothioyl]benzamide Openeye Name: 4-chloro-N-[[3-(3-phenylpropanoylamino)phenyl]carbamothioyl]benzamide CAS Name: 4-chloro-N-[[3-[(1-oxo-3-phenylpropyl)amino]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-chloro-N-[[3-(3-phenylpropanoylamino)phenyl]carbamothioyl]benzamide Traditional Name: 4-chloro-N-[[3-(hydrocinnamoylamino)phenyl]thiocarbamoyl]benzamide Formula: C23H20ClN3O2S MolecularWeight: 437.9418

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(=O)NC2=CC(=CC=C2)NC(=S)NC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)CCC(=O)NC2=CC(=CC=C2)NC(=S)NC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H20ClN3O2S/c24-18-12-10-17(11-13-18)22(29)27-23(30)26-20-8-4-7-19(15-20)25-21(28)14-9-16-5-2-1-3-6-16/h1-8,10-13,15H,9,14H2,(H,25,28)(H2,26,27,29,30)