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

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

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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=C(C=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=C(C=C4)NC(=O)C5=CC(=CC=C5)[N+](=O)[O-]

InChI

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