N-(2-bromophenyl)-2-[4-(2-phenoxyethanoylamino)phenyl]sulfanyl-propanamide

Systemtic Name: N-(2-bromophenyl)-2-[4-(2-phenoxyethanoylamino)phenyl]sulfanyl-propanamide Openeye Name: N-(2-bromophenyl)-2-[4-[(2-phenoxyacetyl)amino]phenyl]sulfanyl-propanamide CAS Name: N-(2-bromophenyl)-2-[[4-[(1-oxo-2-phenoxyethyl)amino]phenyl]thio]propanamide IUPAC Name: N-(2-bromophenyl)-2-[4-[(2-phenoxyacetyl)amino]phenyl]sulfanylpropanamide Traditional Name: N-(2-bromophenyl)-2-[[4-[(2-phenoxyacetyl)amino]phenyl]thio]propionamide Formula: C23H21BrN2O3S MolecularWeight: 485.39344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1Br)SC2=CC=C(C=C2)NC(=O)COC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1Br)SC2=CC=C(C=C2)NC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C23H21BrN2O3S/c1-16(23(28)26-21-10-6-5-9-20(21)24)30-19-13-11-17(12-14-19)25-22(27)15-29-18-7-3-2-4-8-18/h2-14,16H,15H2,1H3,(H,25,27)(H,26,28)