4-nitro-N-[3-(2-thiophen-2-ylethynyl)phenyl]benzenesulfonamide

Systemtic Name: 4-nitro-N-[3-(2-thiophen-2-ylethynyl)phenyl]benzenesulfonamide Openeye Name: 4-nitro-N-[3-[2-(2-thienyl)ethynyl]phenyl]benzenesulfonamide CAS Name: 4-nitro-N-[3-(2-thiophen-2-ylethynyl)phenyl]benzenesulfonamide IUPAC Name: 4-nitro-N-[3-(2-thiophen-2-ylethynyl)phenyl]benzenesulfonamide Traditional Name: 4-nitro-N-[3-[2-(2-thienyl)ethynyl]phenyl]benzenesulfonamide Formula: C18H12N2O4S2 MolecularWeight: 384.42888

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])C#CC3=CC=CS3

Isomeric SMILES

C1=CC(=CC(=C1)NS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])C#CC3=CC=CS3

InChI

InChI=1S/C18H12N2O4S2/c21-20(22)16-7-10-18(11-8-16)26(23,24)19-15-4-1-3-14(13-15)6-9-17-5-2-12-25-17/h1-5,7-8,10-13,19H