N-[4-bromanyl-2-(phenylcarbonyl)phenyl]-3-(4-methoxyphenyl)sulfanyl-propanamide

Systemtic Name: N-[4-bromanyl-2-(phenylcarbonyl)phenyl]-3-(4-methoxyphenyl)sulfanyl-propanamide Openeye Name: N-(2-benzoyl-4-bromo-phenyl)-3-(4-methoxyphenyl)sulfanyl-propanamide CAS Name: N-(2-benzoyl-4-bromophenyl)-3-[(4-methoxyphenyl)thio]propanamide IUPAC Name: N-(2-benzoyl-4-bromophenyl)-3-(4-methoxyphenyl)sulfanylpropanamide Traditional Name: N-(2-benzoyl-4-bromo-phenyl)-3-[(4-methoxyphenyl)thio]propionamide Formula: C23H20BrNO3S MolecularWeight: 470.3788

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)SCCC(=O)NC2=C(C=C(C=C2)Br)C(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)SCCC(=O)NC2=C(C=C(C=C2)Br)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H20BrNO3S/c1-28-18-8-10-19(11-9-18)29-14-13-22(26)25-21-12-7-17(24)15-20(21)23(27)16-5-3-2-4-6-16/h2-12,15H,13-14H2,1H3,(H,25,26)