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

Systemtic Name: (7-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl pyrrolidine-1-carbodithioate Openeye Name: (7-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl pyrrolidine-1-carbodithioate CAS Name: 1-pyrrolidinecarbodithioic acid (7-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl ester IUPAC Name: (7-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl pyrrolidine-1-carbodithioate Traditional Name: pyrrolidine-1-carbodithioic acid (4-keto-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl ester Formula: C15H18N3OS2+ MolecularWeight: 320.45292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+]2=C(C=C1)NC(=CC2=O)CSC(=S)N3CCCC3

Isomeric SMILES

CC1=C[N+]2=C(C=C1)NC(=CC2=O)CSC(=S)N3CCCC3

InChI

InChI=1S/C15H17N3OS2/c1-11-4-5-13-16-12(8-14(19)18(13)9-11)10-21-15(20)17-6-2-3-7-17/h4-5,8-9H,2-3,6-7,10H2,1H3/p+1