N-[2-(3-oxidanylidene-2H-1,3-benzothiazol-3-ium-2-yl)ethyl]pyridine-4-carboxamide

Systemtic Name: N-[2-(3-oxidanylidene-2H-1,3-benzothiazol-3-ium-2-yl)ethyl]pyridine-4-carboxamide Openeye Name: N-[2-(3-oxo-2H-1,3-benzothiazol-3-ium-2-yl)ethyl]pyridine-4-carboxamide CAS Name: N-[2-(3-oxo-2H-1,3-benzothiazol-3-ium-2-yl)ethyl]-4-pyridinecarboxamide IUPAC Name: N-[2-(3-oxo-2H-1,3-benzothiazol-3-ium-2-yl)ethyl]pyridine-4-carboxamide Traditional Name: N-[2-(3-keto-2H-1,3-benzothiazol-3-ium-2-yl)ethyl]isonicotinamide Formula: C15H14N3O2S+ MolecularWeight: 300.35556

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)[N+](=O)C(S2)CCNC(=O)C3=CC=NC=C3

Isomeric SMILES

C1=CC=C2C(=C1)[N+](=O)C(S2)CCNC(=O)C3=CC=NC=C3

InChI

InChI=1S/C15H13N3O2S/c19-15(11-5-8-16-9-6-11)17-10-7-14-18(20)12-3-1-2-4-13(12)21-14/h1-6,8-9,14H,7,10H2/p+1