N-(4-nitrophenyl)-2-[3-(2-phenoxyethanoylamino)phenyl]sulfanyl-propanamide

Systemtic Name: N-(4-nitrophenyl)-2-[3-(2-phenoxyethanoylamino)phenyl]sulfanyl-propanamide Openeye Name: N-(4-nitrophenyl)-2-[3-[(2-phenoxyacetyl)amino]phenyl]sulfanyl-propanamide CAS Name: N-(4-nitrophenyl)-2-[[3-[(1-oxo-2-phenoxyethyl)amino]phenyl]thio]propanamide IUPAC Name: N-(4-nitrophenyl)-2-[3-[(2-phenoxyacetyl)amino]phenyl]sulfanylpropanamide Traditional Name: N-(4-nitrophenyl)-2-[[3-[(2-phenoxyacetyl)amino]phenyl]thio]propionamide Formula: C23H21N3O5S MolecularWeight: 451.49494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])SC2=CC=CC(=C2)NC(=O)COC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])SC2=CC=CC(=C2)NC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C23H21N3O5S/c1-16(23(28)25-17-10-12-19(13-11-17)26(29)30)32-21-9-5-6-18(14-21)24-22(27)15-31-20-7-3-2-4-8-20/h2-14,16H,15H2,1H3,(H,24,27)(H,25,28)