2-[(4-nitrophenyl)methylsulfanyl]quinoline

Systemtic Name: 2-[(4-nitrophenyl)methylsulfanyl]quinoline Openeye Name: 2-[(4-nitrophenyl)methylsulfanyl]quinoline CAS Name: 2-[(4-nitrophenyl)methylthio]quinoline IUPAC Name: 2-[(4-nitrophenyl)methylsulfanyl]quinoline Traditional Name: 2-[(4-nitrobenzyl)thio]quinoline Formula: C16H12N2O2S MolecularWeight: 296.34368

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)SCC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)SCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H12N2O2S/c19-18(20)14-8-5-12(6-9-14)11-21-16-10-7-13-3-1-2-4-15(13)17-16/h1-10H,11H2