2-(sulfanylmethyl)-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 2-(sulfanylmethyl)-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 2-(sulfanylmethyl)-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 2-(mercaptomethyl)-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 2-(sulfanylmethyl)-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 2-(mercaptomethyl)-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C9H9N2OS+ MolecularWeight: 193.24556

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+]2C(=C1)NC(=CC2=O)CS

Isomeric SMILES

C1=CC=[N+]2C(=C1)NC(=CC2=O)CS

InChI

InChI=1S/C9H8N2OS/c12-9-5-7(6-13)10-8-3-1-2-4-11(8)9/h1-5,13H,6H2/p+1