2-oxidanylidene-4-(4-pyridin-4-ylpyridin-1-ium-1-yl)-3H-1,3-thiazole-5-carbaldehyde

Systemtic Name: 2-oxidanylidene-4-(4-pyridin-4-ylpyridin-1-ium-1-yl)-3H-1,3-thiazole-5-carbaldehyde Openeye Name: 2-oxo-4-[4-(4-pyridyl)pyridin-1-ium-1-yl]-3H-thiazole-5-carbaldehyde CAS Name: 2-oxo-4-(4-pyridin-4-yl-1-pyridin-1-iumyl)-3H-thiazole-5-carboxaldehyde IUPAC Name: 2-oxo-4-(4-pyridin-4-ylpyridin-1-ium-1-yl)-3H-1,3-thiazole-5-carbaldehyde Traditional Name: 2-keto-4-[4-(4-pyridyl)pyridin-1-ium-1-yl]-4-thiazoline-5-carbaldehyde Formula: C14H10N3O2S+ MolecularWeight: 284.3131

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC=C1C2=CC=[N+](C=C2)C3=C(SC(=O)N3)C=O

Isomeric SMILES

C1=CN=CC=C1C2=CC=[N+](C=C2)C3=C(SC(=O)N3)C=O

InChI

InChI=1S/C14H9N3O2S/c18-9-12-13(16-14(19)20-12)17-7-3-11(4-8-17)10-1-5-15-6-2-10/h1-9H/p+1