N-(2-methyl-5-nitro-phenyl)-2-[3-(2-phenoxyethanoylamino)phenyl]sulfanyl-2-phenyl-ethanamide

Systemtic Name: N-(2-methyl-5-nitro-phenyl)-2-[3-(2-phenoxyethanoylamino)phenyl]sulfanyl-2-phenyl-ethanamide Openeye Name: N-(2-methyl-5-nitro-phenyl)-2-[3-[(2-phenoxyacetyl)amino]phenyl]sulfanyl-2-phenyl-acetamide CAS Name: N-(2-methyl-5-nitrophenyl)-2-[[3-[(1-oxo-2-phenoxyethyl)amino]phenyl]thio]-2-phenylacetamide IUPAC Name: N-(2-methyl-5-nitrophenyl)-2-[3-[(2-phenoxyacetyl)amino]phenyl]sulfanyl-2-phenylacetamide Traditional Name: N-(2-methyl-5-nitro-phenyl)-2-[[3-[(2-phenoxyacetyl)amino]phenyl]thio]-2-phenyl-acetamide Formula: C29H25N3O5S MolecularWeight: 527.5909

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C(C2=CC=CC=C2)SC3=CC=CC(=C3)NC(=O)COC4=CC=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C(C2=CC=CC=C2)SC3=CC=CC(=C3)NC(=O)COC4=CC=CC=C4

InChI

InChI=1S/C29H25N3O5S/c1-20-15-16-23(32(35)36)18-26(20)31-29(34)28(21-9-4-2-5-10-21)38-25-14-8-11-22(17-25)30-27(33)19-37-24-12-6-3-7-13-24/h2-18,28H,19H2,1H3,(H,30,33)(H,31,34)