2-(4-methylphenyl)-N-(3-oxidanylpyridin-1-ium-2-yl)-1,3-thiazole-4-carboxamide

Systemtic Name: 2-(4-methylphenyl)-N-(3-oxidanylpyridin-1-ium-2-yl)-1,3-thiazole-4-carboxamide Openeye Name: N-(3-hydroxypyridin-1-ium-2-yl)-2-(p-tolyl)thiazole-4-carboxamide CAS Name: N-(3-hydroxy-2-pyridin-1-iumyl)-2-(4-methylphenyl)-4-thiazolecarboxamide IUPAC Name: N-(3-hydroxypyridin-1-ium-2-yl)-2-(4-methylphenyl)-1,3-thiazole-4-carboxamide Traditional Name: N-(3-hydroxypyridin-1-ium-2-yl)-2-(p-tolyl)thiazole-4-carboxamide Formula: C16H14N3O2S+ MolecularWeight: 312.36626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=CS2)C(=O)NC3=C(C=CC=[NH+]3)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=CS2)C(=O)NC3=C(C=CC=[NH+]3)O

InChI

InChI=1S/C16H13N3O2S/c1-10-4-6-11(7-5-10)16-18-12(9-22-16)15(21)19-14-13(20)3-2-8-17-14/h2-9,20H,1H3,(H,17,19,21)/p+1