7-[(4-methylquinolin-2-yl)sulfanylmethyl]-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-5-one

Systemtic Name: 7-[(4-methylquinolin-2-yl)sulfanylmethyl]-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-5-one Openeye Name: 7-[(4-methyl-2-quinolyl)sulfanylmethyl]-8H-thiazolo[3,2-a]pyrimidin-4-ium-5-one CAS Name: 7-[[(4-methyl-2-quinolinyl)thio]methyl]-8H-thiazolo[3,2-a]pyrimidin-4-ium-5-one IUPAC Name: 7-[(4-methylquinolin-2-yl)sulfanylmethyl]-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-5-one Traditional Name: 7-[[(4-methyl-2-quinolyl)thio]methyl]-8H-thiazolo[3,2-a]pyrimidin-4-ium-5-one Formula: C17H14N3OS2+ MolecularWeight: 340.44256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)SCC3=CC(=O)[N+]4=C(N3)SC=C4

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)SCC3=CC(=O)[N+]4=C(N3)SC=C4

InChI

InChI=1S/C17H13N3OS2/c1-11-8-15(19-14-5-3-2-4-13(11)14)23-10-12-9-16(21)20-6-7-22-17(20)18-12/h2-9H,10H2,1H3/p+1