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

Systemtic Name: 3-methyl-7-[(3-methylquinoxalin-2-yl)sulfanylmethyl]-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-5-one Openeye Name: 3-methyl-7-[(3-methylquinoxalin-2-yl)sulfanylmethyl]-8H-thiazolo[3,2-a]pyrimidin-4-ium-5-one CAS Name: 3-methyl-7-[[(3-methyl-2-quinoxalinyl)thio]methyl]-8H-thiazolo[3,2-a]pyrimidin-4-ium-5-one IUPAC Name: 3-methyl-7-[(3-methylquinoxalin-2-yl)sulfanylmethyl]-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-5-one Traditional Name: 3-methyl-7-[[(3-methylquinoxalin-2-yl)thio]methyl]-8H-thiazolo[3,2-a]pyrimidin-4-ium-5-one Formula: C17H15N4OS2+ MolecularWeight: 355.4572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC2=[N+]1C(=O)C=C(N2)CSC3=NC4=CC=CC=C4N=C3C

Isomeric SMILES

CC1=CSC2=[N+]1C(=O)C=C(N2)CSC3=NC4=CC=CC=C4N=C3C

InChI

InChI=1S/C17H14N4OS2/c1-10-8-24-17-19-12(7-15(22)21(10)17)9-23-16-11(2)18-13-5-3-4-6-14(13)20-16/h3-8H,9H2,1-2H3/p+1