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

Systemtic Name: 5-oxidanylidene-N-[(3-phenoxyphenyl)methyl]-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Openeye Name: 5-oxo-N-[(3-phenoxyphenyl)methyl]-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide CAS Name: 5-oxo-N-[(3-phenoxyphenyl)methyl]-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide IUPAC Name: 5-oxo-N-[(3-phenoxyphenyl)methyl]-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Traditional Name: 5-keto-N-(3-phenoxybenzyl)-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Formula: C20H16N3O3S+ MolecularWeight: 378.42434

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=CC(=C2)CNC(=O)C3=CNC4=[N+](C3=O)C=CS4

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=CC(=C2)CNC(=O)C3=CNC4=[N+](C3=O)C=CS4

InChI

InChI=1S/C20H15N3O3S/c24-18(17-13-22-20-23(19(17)25)9-10-27-20)21-12-14-5-4-8-16(11-14)26-15-6-2-1-3-7-15/h1-11,13H,12H2,(H,21,24)/p+1