N-[2-[2,2-bis[(2-nitrophenyl)methylsulfanyl]ethyl]-4-oxidanylidene-azetidin-3-yl]-2-phenyl-ethanamide

Systemtic Name: N-[2-[2,2-bis[(2-nitrophenyl)methylsulfanyl]ethyl]-4-oxidanylidene-azetidin-3-yl]-2-phenyl-ethanamide Openeye Name: N-[2-[2,2-bis[(2-nitrophenyl)methylsulfanyl]ethyl]-4-oxo-azetidin-3-yl]-2-phenyl-acetamide CAS Name: N-[2-[2,2-bis[(2-nitrophenyl)methylthio]ethyl]-4-oxo-3-azetidinyl]-2-phenylacetamide IUPAC Name: N-[2-[2,2-bis[(2-nitrophenyl)methylsulfanyl]ethyl]-4-oxoazetidin-3-yl]-2-phenylacetamide Traditional Name: N-[2-[2,2-bis[(2-nitrobenzyl)thio]ethyl]-4-keto-azetidin-3-yl]-2-phenyl-acetamide Formula: C27H26N4O6S2 MolecularWeight: 566.64854

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)NC2C(NC2=O)CC(SCC3=CC=CC=C3[N+](=O)[O-])SCC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)NC2C(NC2=O)CC(SCC3=CC=CC=C3[N+](=O)[O-])SCC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C27H26N4O6S2/c32-24(14-18-8-2-1-3-9-18)29-26-21(28-27(26)33)15-25(38-16-19-10-4-6-12-22(19)30(34)35)39-17-20-11-5-7-13-23(20)31(36)37/h1-13,21,25-26H,14-17H2,(H,28,33)(H,29,32)