2-nitro-5-quinolin-2-ylsulfanyl-benzenecarbonitrile

Systemtic Name: 2-nitro-5-quinolin-2-ylsulfanyl-benzenecarbonitrile Openeye Name: 2-nitro-5-(2-quinolylsulfanyl)benzonitrile CAS Name: 2-nitro-5-(2-quinolinylthio)benzonitrile IUPAC Name: 2-nitro-5-quinolin-2-ylsulfanylbenzonitrile Traditional Name: 2-nitro-5-(2-quinolylthio)benzonitrile Formula: C16H9N3O2S MolecularWeight: 307.32656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)SC3=CC(=C(C=C3)[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)SC3=CC(=C(C=C3)[N+](=O)[O-])C#N

InChI

InChI=1S/C16H9N3O2S/c17-10-12-9-13(6-7-15(12)19(20)21)22-16-8-5-11-3-1-2-4-14(11)18-16/h1-9H