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

Systemtic Name: N-(4-ethylphenyl)-3-methyl-5-oxidanylidene-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Openeye Name: N-(4-ethylphenyl)-3-methyl-5-oxo-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide CAS Name: N-(4-ethylphenyl)-3-methyl-5-oxo-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide IUPAC Name: N-(4-ethylphenyl)-3-methyl-5-oxo-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Traditional Name: N-(4-ethylphenyl)-5-keto-3-methyl-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=C(C=C1)NC(=O)C2=CNC3=[N+](C2=O)C(=CS3)C

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C2=CNC3=[N+](C2=O)C(=CS3)C

InChI

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