4-(4-nitrophenyl)sulfanylbenzenecarbonitrile

Systemtic Name: 4-(4-nitrophenyl)sulfanylbenzenecarbonitrile Openeye Name: 4-(4-nitrophenyl)sulfanylbenzonitrile CAS Name: 4-[(4-nitrophenyl)thio]benzonitrile IUPAC Name: 4-(4-nitrophenyl)sulfanylbenzonitrile Traditional Name: 4-[(4-nitrophenyl)thio]benzonitrile Formula: C13H8N2O2S MolecularWeight: 256.27982

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)SC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C#N)SC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H8N2O2S/c14-9-10-1-5-12(6-2-10)18-13-7-3-11(4-8-13)15(16)17/h1-8H