1-oxidanidyl-N-[3-(thiophen-2-ylcarbonylamino)phenyl]pyridin-1-ium-2-carboxamide

Systemtic Name: 1-oxidanidyl-N-[3-(thiophen-2-ylcarbonylamino)phenyl]pyridin-1-ium-2-carboxamide Openeye Name: 1-oxido-N-[3-(thiophene-2-carbonylamino)phenyl]pyridin-1-ium-2-carboxamide CAS Name: 1-oxido-N-[3-[[oxo(thiophen-2-yl)methyl]amino]phenyl]-2-pyridin-1-iumcarboxamide IUPAC Name: 1-oxido-N-[3-(thiophene-2-carbonylamino)phenyl]pyridin-1-ium-2-carboxamide Traditional Name: 1-oxido-N-[3-(2-thenoylamino)phenyl]pyridin-1-ium-2-carboxamide Formula: C17H13N3O3S MolecularWeight: 339.36842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C(=C1)C(=O)NC2=CC(=CC=C2)NC(=O)C3=CC=CS3)[O-]

Isomeric SMILES

C1=CC=[N+](C(=C1)C(=O)NC2=CC(=CC=C2)NC(=O)C3=CC=CS3)[O-]

InChI

InChI=1S/C17H13N3O3S/c21-16(14-7-1-2-9-20(14)23)18-12-5-3-6-13(11-12)19-17(22)15-8-4-10-24-15/h1-11H,(H,18,21)(H,19,22)