6-oxidanylidene-N-[3-(2-thiophen-2-ylethynyl)phenyl]-1H-pyridazine-3-carboxamide

Systemtic Name: 6-oxidanylidene-N-[3-(2-thiophen-2-ylethynyl)phenyl]-1H-pyridazine-3-carboxamide Openeye Name: 6-oxo-N-[3-[2-(2-thienyl)ethynyl]phenyl]-1H-pyridazine-3-carboxamide CAS Name: 6-oxo-N-[3-(2-thiophen-2-ylethynyl)phenyl]-1H-pyridazine-3-carboxamide IUPAC Name: 6-oxo-N-[3-(2-thiophen-2-ylethynyl)phenyl]-1H-pyridazine-3-carboxamide Traditional Name: 6-keto-N-[3-[2-(2-thienyl)ethynyl]phenyl]-1H-pyridazine-3-carboxamide Formula: C17H11N3O2S MolecularWeight: 321.35314

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)C2=NNC(=O)C=C2)C#CC3=CC=CS3

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)C2=NNC(=O)C=C2)C#CC3=CC=CS3

InChI

InChI=1S/C17H11N3O2S/c21-16-9-8-15(19-20-16)17(22)18-13-4-1-3-12(11-13)6-7-14-5-2-10-23-14/h1-5,8-11H,(H,18,22)(H,20,21)