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

Systemtic Name: 5-oxidanylidene-N-(2-pyrrolidin-1-ylphenyl)-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Openeye Name: 5-oxo-N-(2-pyrrolidin-1-ylphenyl)-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide CAS Name: 5-oxo-N-[2-(1-pyrrolidinyl)phenyl]-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide IUPAC Name: 5-oxo-N-(2-pyrrolidin-1-ylphenyl)-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Traditional Name: 5-keto-N-(2-pyrrolidinophenyl)-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Formula: C17H17N4O2S+ MolecularWeight: 341.40748

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC=CC=C2NC(=O)C3=CNC4=[N+](C3=O)C=CS4

Isomeric SMILES

C1CCN(C1)C2=CC=CC=C2NC(=O)C3=CNC4=[N+](C3=O)C=CS4

InChI

InChI=1S/C17H16N4O2S/c22-15(12-11-18-17-21(16(12)23)9-10-24-17)19-13-5-1-2-6-14(13)20-7-3-4-8-20/h1-2,5-6,9-11H,3-4,7-8H2,(H,19,22)/p+1