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

Systemtic Name: 3-methyl-7-[(4-oxidanylidenequinazolin-3-yl)methyl]-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-5-one Openeye Name: 3-methyl-7-[(4-oxoquinazolin-3-yl)methyl]-8H-thiazolo[3,2-a]pyrimidin-4-ium-5-one CAS Name: 3-methyl-7-[(4-oxo-3-quinazolinyl)methyl]-8H-thiazolo[3,2-a]pyrimidin-4-ium-5-one IUPAC Name: 3-methyl-7-[(4-oxoquinazolin-3-yl)methyl]-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-5-one Traditional Name: 7-[(4-ketoquinazolin-3-yl)methyl]-3-methyl-8H-thiazolo[3,2-a]pyrimidin-4-ium-5-one Formula: C16H13N4O2S+ MolecularWeight: 325.36502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC2=[N+]1C(=O)C=C(N2)CN3C=NC4=CC=CC=C4C3=O

Isomeric SMILES

CC1=CSC2=[N+]1C(=O)C=C(N2)CN3C=NC4=CC=CC=C4C3=O

InChI

InChI=1S/C16H12N4O2S/c1-10-8-23-16-18-11(6-14(21)20(10)16)7-19-9-17-13-5-3-2-4-12(13)15(19)22/h2-6,8-9H,7H2,1H3/p+1