N-[4-bromanyl-2-(2-chlorophenyl)carbonyl-phenyl]-3-(4-fluorophenyl)sulfanyl-propanamide

Systemtic Name: N-[4-bromanyl-2-(2-chlorophenyl)carbonyl-phenyl]-3-(4-fluorophenyl)sulfanyl-propanamide Openeye Name: N-[4-bromo-2-(2-chlorobenzoyl)phenyl]-3-(4-fluorophenyl)sulfanyl-propanamide CAS Name: N-[4-bromo-2-[(2-chlorophenyl)-oxomethyl]phenyl]-3-[(4-fluorophenyl)thio]propanamide IUPAC Name: N-[4-bromo-2-(2-chlorobenzoyl)phenyl]-3-(4-fluorophenyl)sulfanylpropanamide Traditional Name: N-[4-bromo-2-(2-chlorobenzoyl)phenyl]-3-[(4-fluorophenyl)thio]propionamide Formula: C22H16BrClFNO2S MolecularWeight: 492.788343

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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)CCSC3=CC=C(C=C3)F)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)C2=C(C=CC(=C2)Br)NC(=O)CCSC3=CC=C(C=C3)F)Cl

InChI

InChI=1S/C22H16BrClFNO2S/c23-14-5-10-20(18(13-14)22(28)17-3-1-2-4-19(17)24)26-21(27)11-12-29-16-8-6-15(25)7-9-16/h1-10,13H,11-12H2,(H,26,27)