2-[(3-nitrophenyl)methylsulfanyl]-5-phenyl-1H-imidazole

Systemtic Name: 2-[(3-nitrophenyl)methylsulfanyl]-5-phenyl-1H-imidazole Openeye Name: 2-[(3-nitrophenyl)methylsulfanyl]-5-phenyl-1H-imidazole CAS Name: 2-[(3-nitrophenyl)methylthio]-5-phenyl-1H-imidazole IUPAC Name: 2-[(3-nitrophenyl)methylsulfanyl]-5-phenyl-1H-imidazole Traditional Name: 2-[(3-nitrobenzyl)thio]-5-phenyl-1H-imidazole Formula: C16H13N3O2S MolecularWeight: 311.35832

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CN=C(N2)SCC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CN=C(N2)SCC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H13N3O2S/c20-19(21)14-8-4-5-12(9-14)11-22-16-17-10-15(18-16)13-6-2-1-3-7-13/h1-10H,11H2,(H,17,18)