N-[3-[[3-(2-thiophen-2-ylethynyl)phenyl]carbamoyl]phenyl]thiophene-2-carboxamide

Systemtic Name: N-[3-[[3-(2-thiophen-2-ylethynyl)phenyl]carbamoyl]phenyl]thiophene-2-carboxamide Openeye Name: N-[3-[[3-[2-(2-thienyl)ethynyl]phenyl]carbamoyl]phenyl]thiophene-2-carboxamide CAS Name: N-[3-[oxo-[3-(2-thiophen-2-ylethynyl)anilino]methyl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[3-[[3-(2-thiophen-2-ylethynyl)phenyl]carbamoyl]phenyl]thiophene-2-carboxamide Traditional Name: N-[3-[[3-[2-(2-thienyl)ethynyl]phenyl]carbamoyl]phenyl]thiophene-2-carboxamide Formula: C24H16N2O2S2 MolecularWeight: 428.52604

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)C2=CC(=CC=C2)NC(=O)C3=CC=CS3)C#CC4=CC=CS4

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)C2=CC(=CC=C2)NC(=O)C3=CC=CS3)C#CC4=CC=CS4

InChI

InChI=1S/C24H16N2O2S2/c27-23(18-6-2-8-20(16-18)26-24(28)22-10-4-14-30-22)25-19-7-1-5-17(15-19)11-12-21-9-3-13-29-21/h1-10,13-16H,(H,25,27)(H,26,28)