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

Systemtic Name: 4-methyl-3-nitro-N-[3-(2-thiophen-2-ylethynyl)phenyl]benzenesulfonamide Openeye Name: 4-methyl-3-nitro-N-[3-[2-(2-thienyl)ethynyl]phenyl]benzenesulfonamide CAS Name: 4-methyl-3-nitro-N-[3-(2-thiophen-2-ylethynyl)phenyl]benzenesulfonamide IUPAC Name: 4-methyl-3-nitro-N-[3-(2-thiophen-2-ylethynyl)phenyl]benzenesulfonamide Traditional Name: 4-methyl-3-nitro-N-[3-[2-(2-thienyl)ethynyl]phenyl]benzenesulfonamide Formula: C19H14N2O4S2 MolecularWeight: 398.45546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C#CC3=CC=CS3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C#CC3=CC=CS3)[N+](=O)[O-]

InChI

InChI=1S/C19H14N2O4S2/c1-14-7-10-18(13-19(14)21(22)23)27(24,25)20-16-5-2-4-15(12-16)8-9-17-6-3-11-26-17/h2-7,10-13,20H,1H3