4-nitro-2-[4-phenyl-5-(4-phenylsulfanylphenyl)-1H-imidazol-2-yl]phenolate

Systemtic Name: 4-nitro-2-[4-phenyl-5-(4-phenylsulfanylphenyl)-1H-imidazol-2-yl]phenolate Openeye Name: 4-nitro-2-[4-phenyl-5-(4-phenylsulfanylphenyl)-1H-imidazol-2-yl]phenolate CAS Name: 4-nitro-2-[4-phenyl-5-[4-(phenylthio)phenyl]-1H-imidazol-2-yl]phenolate IUPAC Name: 4-nitro-2-[4-phenyl-5-(4-phenylsulfanylphenyl)-1H-imidazol-2-yl]phenolate Traditional Name: 4-nitro-2-[4-phenyl-5-[4-(phenylthio)phenyl]-1H-imidazol-2-yl]phenolate Formula: C27H18N3O3S- MolecularWeight: 464.51512

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(NC(=N2)C3=C(C=CC(=C3)[N+](=O)[O-])[O-])C4=CC=C(C=C4)SC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=C(NC(=N2)C3=C(C=CC(=C3)[N+](=O)[O-])[O-])C4=CC=C(C=C4)SC5=CC=CC=C5

InChI

InChI=1S/C27H19N3O3S/c31-24-16-13-20(30(32)33)17-23(24)27-28-25(18-7-3-1-4-8-18)26(29-27)19-11-14-22(15-12-19)34-21-9-5-2-6-10-21/h1-17,31H,(H,28,29)/p-1