7-bromanyl-2-methylsulfanyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbonitrile

Systemtic Name: 7-bromanyl-2-methylsulfanyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbonitrile Openeye Name: 7-bromo-2-methylsulfanyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbonitrile CAS Name: 7-bromo-2-(methylthio)-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbonitrile IUPAC Name: 7-bromo-2-methylsulfanyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbonitrile Traditional Name: 7-bromo-4-keto-2-(methylthio)-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbonitrile Formula: C10H7BrN3OS+ MolecularWeight: 297.15108

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C(=O)[N+]2=C(N1)C=CC(=C2)Br)C#N

Isomeric SMILES

CSC1=C(C(=O)[N+]2=C(N1)C=CC(=C2)Br)C#N

InChI

InChI=1S/C10H6BrN3OS/c1-16-9-7(4-12)10(15)14-5-6(11)2-3-8(14)13-9/h2-3,5H,1H3/p+1