7-chloranyl-2-(pyridin-2-ylsulfanylmethyl)-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 7-chloranyl-2-(pyridin-2-ylsulfanylmethyl)-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 7-chloro-2-(2-pyridylsulfanylmethyl)-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 7-chloro-2-[(2-pyridinylthio)methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 7-chloro-2-(pyridin-2-ylsulfanylmethyl)-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 7-chloro-2-[(2-pyridylthio)methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C14H11ClN3OS+ MolecularWeight: 304.77464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)SCC2=CC(=O)[N+]3=C(N2)C=CC(=C3)Cl

Isomeric SMILES

C1=CC=NC(=C1)SCC2=CC(=O)[N+]3=C(N2)C=CC(=C3)Cl

InChI

InChI=1S/C14H10ClN3OS/c15-10-4-5-12-17-11(7-14(19)18(12)8-10)9-20-13-3-1-2-6-16-13/h1-8H,9H2/p+1