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

Systemtic Name: 3-methyl-7-[(4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanylmethyl]-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-5-one Openeye Name: 3-methyl-7-[(4-oxo-3-propyl-quinazolin-2-yl)sulfanylmethyl]-8H-thiazolo[3,2-a]pyrimidin-4-ium-5-one CAS Name: 3-methyl-7-[[(4-oxo-3-propyl-2-quinazolinyl)thio]methyl]-8H-thiazolo[3,2-a]pyrimidin-4-ium-5-one IUPAC Name: 3-methyl-7-[(4-oxo-3-propylquinazolin-2-yl)sulfanylmethyl]-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-5-one Traditional Name: 7-[[(4-keto-3-propyl-quinazolin-2-yl)thio]methyl]-3-methyl-8H-thiazolo[3,2-a]pyrimidin-4-ium-5-one Formula: C19H19N4O2S2+ MolecularWeight: 399.50976

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC(=O)[N+]4=C(N3)SC=C4C

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC(=O)[N+]4=C(N3)SC=C4C

InChI

InChI=1S/C19H18N4O2S2/c1-3-8-22-17(25)14-6-4-5-7-15(14)21-18(22)27-11-13-9-16(24)23-12(2)10-26-19(23)20-13/h4-7,9-10H,3,8,11H2,1-2H3/p+1