4-isoquinolin-2-ium-2-yl-3-methyl-2-oxidanylidene-1,3-thiazole-5-carbaldehyde

Systemtic Name: 4-isoquinolin-2-ium-2-yl-3-methyl-2-oxidanylidene-1,3-thiazole-5-carbaldehyde Openeye Name: 4-isoquinolin-2-ium-2-yl-3-methyl-2-oxo-thiazole-5-carbaldehyde CAS Name: 4-(2-isoquinolin-2-iumyl)-3-methyl-2-oxo-5-thiazolecarboxaldehyde IUPAC Name: 4-isoquinolin-2-ium-2-yl-3-methyl-2-oxo-1,3-thiazole-5-carbaldehyde Traditional Name: 4-isoquinolin-2-ium-2-yl-2-keto-3-methyl-4-thiazoline-5-carbaldehyde Formula: C14H11N2O2S+ MolecularWeight: 271.31434

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(SC1=O)C=O)[N+]2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CN1C(=C(SC1=O)C=O)[N+]2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C14H11N2O2S/c1-15-13(12(9-17)19-14(15)18)16-7-6-10-4-2-3-5-11(10)8-16/h2-9H,1H3/q+1