N-[4-bromanyl-2-(phenylcarbonyl)phenyl]-4-phenylsulfanyl-butanamide

Systemtic Name: N-[4-bromanyl-2-(phenylcarbonyl)phenyl]-4-phenylsulfanyl-butanamide Openeye Name: N-(2-benzoyl-4-bromo-phenyl)-4-phenylsulfanyl-butanamide CAS Name: N-(2-benzoyl-4-bromophenyl)-4-(phenylthio)butanamide IUPAC Name: N-(2-benzoyl-4-bromophenyl)-4-phenylsulfanylbutanamide Traditional Name: N-(2-benzoyl-4-bromo-phenyl)-4-(phenylthio)butyramide Formula: C23H20BrNO2S MolecularWeight: 454.3794

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)Br)NC(=O)CCCSC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)Br)NC(=O)CCCSC3=CC=CC=C3

InChI

InChI=1S/C23H20BrNO2S/c24-18-13-14-21(20(16-18)23(27)17-8-3-1-4-9-17)25-22(26)12-7-15-28-19-10-5-2-6-11-19/h1-6,8-11,13-14,16H,7,12,15H2,(H,25,26)