3-azanyl-7-(3-methoxyphenyl)-5-oxidanylidene-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-2,6-dicarbonitrile

Systemtic Name: 3-azanyl-7-(3-methoxyphenyl)-5-oxidanylidene-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-2,6-dicarbonitrile Openeye Name: 3-amino-7-(3-methoxyphenyl)-5-oxo-8H-thiazolo[3,2-a]pyrimidin-4-ium-2,6-dicarbonitrile CAS Name: 3-amino-7-(3-methoxyphenyl)-5-oxo-8H-thiazolo[3,2-a]pyrimidin-4-ium-2,6-dicarbonitrile IUPAC Name: 3-amino-7-(3-methoxyphenyl)-5-oxo-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-2,6-dicarbonitrile Traditional Name: 3-amino-5-keto-7-(3-methoxyphenyl)-8H-thiazolo[3,2-a]pyrimidin-4-ium-2,6-dicarbonitrile Formula: C15H10N5O2S+ MolecularWeight: 324.3372

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=C(C(=O)[N+]3=C(N2)SC(=C3N)C#N)C#N

Isomeric SMILES

COC1=CC=CC(=C1)C2=C(C(=O)[N+]3=C(N2)SC(=C3N)C#N)C#N

InChI

InChI=1S/C15H9N5O2S/c1-22-9-4-2-3-8(5-9)12-10(6-16)14(21)20-13(18)11(7-17)23-15(20)19-12/h2-5H,18H2,1H3/p+1