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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CNC2=[N+](C1=O)C(=CS2)C3=CC=C(C=C3)C

Isomeric SMILES

CCNC(=O)C1=CNC2=[N+](C1=O)C(=CS2)C3=CC=C(C=C3)C

InChI

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