4-(4-tert-butylpyridin-1-ium-1-yl)-2-oxidanylidene-3H-1,3-thiazole-5-carbaldehyde

Systemtic Name: 4-(4-tert-butylpyridin-1-ium-1-yl)-2-oxidanylidene-3H-1,3-thiazole-5-carbaldehyde Openeye Name: 4-(4-tert-butylpyridin-1-ium-1-yl)-2-oxo-3H-thiazole-5-carbaldehyde CAS Name: 4-(4-tert-butyl-1-pyridin-1-iumyl)-2-oxo-3H-thiazole-5-carboxaldehyde IUPAC Name: 4-(4-tert-butylpyridin-1-ium-1-yl)-2-oxo-3H-1,3-thiazole-5-carbaldehyde Traditional Name: 4-(4-tert-butylpyridin-1-ium-1-yl)-2-keto-4-thiazoline-5-carbaldehyde Formula: C13H15N2O2S+ MolecularWeight: 263.3354

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=[N+](C=C1)C2=C(SC(=O)N2)C=O

Isomeric SMILES

CC(C)(C)C1=CC=[N+](C=C1)C2=C(SC(=O)N2)C=O

InChI

InChI=1S/C13H14N2O2S/c1-13(2,3)9-4-6-15(7-5-9)11-10(8-16)18-12(17)14-11/h4-8H,1-3H3/p+1