3-nitro-N-[3-[2-oxidanylidene-2-[(4-phenoxyphenyl)amino]-1-phenyl-ethyl]sulfanylphenyl]benzamide

Systemtic Name: 3-nitro-N-[3-[2-oxidanylidene-2-[(4-phenoxyphenyl)amino]-1-phenyl-ethyl]sulfanylphenyl]benzamide Openeye Name: 3-nitro-N-[3-[2-oxo-2-(4-phenoxyanilino)-1-phenyl-ethyl]sulfanylphenyl]benzamide CAS Name: 3-nitro-N-[3-[[2-oxo-2-(4-phenoxyanilino)-1-phenylethyl]thio]phenyl]benzamide IUPAC Name: 3-nitro-N-[3-[2-oxo-2-(4-phenoxyanilino)-1-phenylethyl]sulfanylphenyl]benzamide Traditional Name: N-[3-[[2-keto-2-(4-phenoxyanilino)-1-phenyl-ethyl]thio]phenyl]-3-nitro-benzamide Formula: C33H25N3O5S MolecularWeight: 575.6337

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)NC2=CC=C(C=C2)OC3=CC=CC=C3)SC4=CC=CC(=C4)NC(=O)C5=CC(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)NC2=CC=C(C=C2)OC3=CC=CC=C3)SC4=CC=CC(=C4)NC(=O)C5=CC(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C33H25N3O5S/c37-32(24-11-7-13-27(21-24)36(39)40)35-26-12-8-16-30(22-26)42-31(23-9-3-1-4-10-23)33(38)34-25-17-19-29(20-18-25)41-28-14-5-2-6-15-28/h1-22,31H,(H,34,38)(H,35,37)