N-(7-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)thiophene-2-carboxamide

Systemtic Name: N-(7-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)thiophene-2-carboxamide Openeye Name: N-(7-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)thiophene-2-carboxamide CAS Name: N-(7-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)-2-thiophenecarboxamide IUPAC Name: N-(7-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)thiophene-2-carboxamide Traditional Name: N-(4-keto-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)thiophene-2-carboxamide Formula: C14H12N3O2S+ MolecularWeight: 286.32898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+]2=C(C=C1)NC=C(C2=O)NC(=O)C3=CC=CS3

Isomeric SMILES

CC1=C[N+]2=C(C=C1)NC=C(C2=O)NC(=O)C3=CC=CS3

InChI

InChI=1S/C14H11N3O2S/c1-9-4-5-12-15-7-10(14(19)17(12)8-9)16-13(18)11-3-2-6-20-11/h2-8H,1H3,(H,16,18)/p+1