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

Systemtic Name: N-(3-methoxypropyl)-5-oxidanylidene-3-phenyl-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Openeye Name: N-(3-methoxypropyl)-5-oxo-3-phenyl-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide CAS Name: N-(3-methoxypropyl)-5-oxo-3-phenyl-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide IUPAC Name: N-(3-methoxypropyl)-5-oxo-3-phenyl-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Traditional Name: 5-keto-N-(3-methoxypropyl)-3-phenyl-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Formula: C17H18N3O3S+ MolecularWeight: 344.40812

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N3O3S/c1-23-9-5-8-18-15(21)13-10-19-17-20(16(13)22)14(11-24-17)12-6-3-2-4-7-12/h2-4,6-7,10-11H,5,8-9H2,1H3,(H,18,21)/p+1