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

Systemtic Name: 2-oxidanylidene-4-[3-(phenylmethyl)pyridin-1-ium-1-yl]-3H-1,3-thiazole-5-carbaldehyde Openeye Name: 4-(3-benzylpyridin-1-ium-1-yl)-2-oxo-3H-thiazole-5-carbaldehyde CAS Name: 2-oxo-4-[3-(phenylmethyl)-1-pyridin-1-iumyl]-3H-thiazole-5-carboxaldehyde IUPAC Name: 4-(3-benzylpyridin-1-ium-1-yl)-2-oxo-3H-1,3-thiazole-5-carbaldehyde Traditional Name: 4-(3-benzylpyridin-1-ium-1-yl)-2-keto-4-thiazoline-5-carbaldehyde Formula: C16H13N2O2S+ MolecularWeight: 297.35162

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=C[N+](=CC=C2)C3=C(SC(=O)N3)C=O

Isomeric SMILES

C1=CC=C(C=C1)CC2=C[N+](=CC=C2)C3=C(SC(=O)N3)C=O

InChI

InChI=1S/C16H12N2O2S/c19-11-14-15(17-16(20)21-14)18-8-4-7-13(10-18)9-12-5-2-1-3-6-12/h1-8,10-11H,9H2/p+1