(7-bromanyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl pyrrolidine-1-carbodithioate

Systemtic Name: (7-bromanyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl pyrrolidine-1-carbodithioate Openeye Name: (7-bromo-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl pyrrolidine-1-carbodithioate CAS Name: 1-pyrrolidinecarbodithioic acid (7-bromo-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl ester IUPAC Name: (7-bromo-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl pyrrolidine-1-carbodithioate Traditional Name: pyrrolidine-1-carbodithioic acid (7-bromo-4-keto-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl ester Formula: C14H15BrN3OS2+ MolecularWeight: 385.3224

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=S)SCC2=CC(=O)[N+]3=C(N2)C=CC(=C3)Br

Isomeric SMILES

C1CCN(C1)C(=S)SCC2=CC(=O)[N+]3=C(N2)C=CC(=C3)Br

InChI

InChI=1S/C14H14BrN3OS2/c15-10-3-4-12-16-11(7-13(19)18(12)8-10)9-21-14(20)17-5-1-2-6-17/h3-4,7-8H,1-2,5-6,9H2/p+1