5-oxidanylidene-N-(3-propyl-1H-benzimidazol-3-ium-2-yl)-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide

Systemtic Name: 5-oxidanylidene-N-(3-propyl-1H-benzimidazol-3-ium-2-yl)-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide Openeye Name: 5-oxo-N-(3-propyl-1H-benzimidazol-3-ium-2-yl)thiazolo[3,2-a]pyrimidine-6-carboxamide CAS Name: 5-oxo-N-(3-propyl-1H-benzimidazol-3-ium-2-yl)-6-thiazolo[3,2-a]pyrimidinecarboxamide IUPAC Name: 5-oxo-N-(3-propyl-1H-benzimidazol-3-ium-2-yl)-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide Traditional Name: 5-keto-N-(3-propyl-1H-benzimidazol-3-ium-2-yl)thiazolo[3,2-a]pyrimidine-6-carboxamide Formula: C17H16N5O2S+ MolecularWeight: 354.40624

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+]1=C(NC2=CC=CC=C21)NC(=O)C3=CN=C4N(C3=O)C=CS4

Isomeric SMILES

CCC[N+]1=C(NC2=CC=CC=C21)NC(=O)C3=CN=C4N(C3=O)C=CS4

InChI

InChI=1S/C17H15N5O2S/c1-2-7-21-13-6-4-3-5-12(13)19-16(21)20-14(23)11-10-18-17-22(15(11)24)8-9-25-17/h3-6,8-10H,2,7H2,1H3,(H,19,20,23)/p+1