N-[4-bromanyl-2-(phenylcarbonyl)phenyl]-3-methylsulfanyl-benzamide

Systemtic Name: N-[4-bromanyl-2-(phenylcarbonyl)phenyl]-3-methylsulfanyl-benzamide Openeye Name: N-(2-benzoyl-4-bromo-phenyl)-3-methylsulfanyl-benzamide CAS Name: N-(2-benzoyl-4-bromophenyl)-3-(methylthio)benzamide IUPAC Name: N-(2-benzoyl-4-bromophenyl)-3-methylsulfanylbenzamide Traditional Name: N-(2-benzoyl-4-bromo-phenyl)-3-(methylthio)benzamide Formula: C21H16BrNO2S MolecularWeight: 426.32624

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)C(=O)NC2=C(C=C(C=C2)Br)C(=O)C3=CC=CC=C3

Isomeric SMILES

CSC1=CC=CC(=C1)C(=O)NC2=C(C=C(C=C2)Br)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H16BrNO2S/c1-26-17-9-5-8-15(12-17)21(25)23-19-11-10-16(22)13-18(19)20(24)14-6-3-2-4-7-14/h2-13H,1H3,(H,23,25)