2-[2-[(5-nitroquinolin-8-yl)amino]ethylsulfanylmethyl]benzenecarbonitrile

Systemtic Name: 2-[2-[(5-nitroquinolin-8-yl)amino]ethylsulfanylmethyl]benzenecarbonitrile Openeye Name: 2-[2-[(5-nitro-8-quinolyl)amino]ethylsulfanylmethyl]benzonitrile CAS Name: 2-[[2-[(5-nitro-8-quinolinyl)amino]ethylthio]methyl]benzonitrile IUPAC Name: 2-[2-[(5-nitroquinolin-8-yl)amino]ethylsulfanylmethyl]benzonitrile Traditional Name: 2-[[2-[(5-nitro-8-quinolyl)amino]ethylthio]methyl]benzonitrile Formula: C19H16N4O2S MolecularWeight: 364.42094

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSCCNC2=C3C(=C(C=C2)[N+](=O)[O-])C=CC=N3)C#N

Isomeric SMILES

C1=CC=C(C(=C1)CSCCNC2=C3C(=C(C=C2)[N+](=O)[O-])C=CC=N3)C#N

InChI

InChI=1S/C19H16N4O2S/c20-12-14-4-1-2-5-15(14)13-26-11-10-21-17-7-8-18(23(24)25)16-6-3-9-22-19(16)17/h1-9,21H,10-11,13H2