N-(2-ethyl-6-methyl-phenyl)-5-oxidanylidene-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide

Systemtic Name: N-(2-ethyl-6-methyl-phenyl)-5-oxidanylidene-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Openeye Name: N-(2-ethyl-6-methyl-phenyl)-5-oxo-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide CAS Name: N-(2-ethyl-6-methylphenyl)-5-oxo-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide IUPAC Name: N-(2-ethyl-6-methylphenyl)-5-oxo-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Traditional Name: N-(2-ethyl-6-methyl-phenyl)-5-keto-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Formula: C16H16N3O2S+ MolecularWeight: 314.38214

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)C2=CNC3=[N+](C2=O)C=CS3)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)C2=CNC3=[N+](C2=O)C=CS3)C

InChI

InChI=1S/C16H15N3O2S/c1-3-11-6-4-5-10(2)13(11)18-14(20)12-9-17-16-19(15(12)21)7-8-22-16/h4-9H,3H2,1-2H3,(H,18,20)/p+1