N-[4-(4-nitrophenyl)sulfonylphenyl]-4-phenylsulfanyl-butanamide

Systemtic Name: N-[4-(4-nitrophenyl)sulfonylphenyl]-4-phenylsulfanyl-butanamide Openeye Name: N-[4-(4-nitrophenyl)sulfonylphenyl]-4-phenylsulfanyl-butanamide CAS Name: N-[4-(4-nitrophenyl)sulfonylphenyl]-4-(phenylthio)butanamide IUPAC Name: N-[4-(4-nitrophenyl)sulfonylphenyl]-4-phenylsulfanylbutanamide Traditional Name: N-(4-nosylphenyl)-4-(phenylthio)butyramide Formula: C22H20N2O5S2 MolecularWeight: 456.5346

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCCC(=O)NC2=CC=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)SCCCC(=O)NC2=CC=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H20N2O5S2/c25-22(7-4-16-30-19-5-2-1-3-6-19)23-17-8-12-20(13-9-17)31(28,29)21-14-10-18(11-15-21)24(26)27/h1-3,5-6,8-15H,4,7,16H2,(H,23,25)