3-ethyl-2-methyl-4-methylsulfanyl-pyrido[1,2-a]pyrimidin-5-ium

Systemtic Name: 3-ethyl-2-methyl-4-methylsulfanyl-pyrido[1,2-a]pyrimidin-5-ium Openeye Name: 3-ethyl-2-methyl-4-methylsulfanyl-pyrido[1,2-a]pyrimidin-5-ium CAS Name: 3-ethyl-2-methyl-4-(methylthio)pyrido[1,2-a]pyrimidin-5-ium IUPAC Name: 3-ethyl-2-methyl-4-methylsulfanylpyrido[1,2-a]pyrimidin-5-ium Traditional Name: 3-ethyl-2-methyl-4-(methylthio)pyrido[1,2-a]pyrimidin-5-ium Formula: C12H15N2S+ MolecularWeight: 219.3259

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C([N+]2=CC=CC=C2N=C1C)SC

Isomeric SMILES

CCC1=C([N+]2=CC=CC=C2N=C1C)SC

InChI

InChI=1S/C12H15N2S/c1-4-10-9(2)13-11-7-5-6-8-14(11)12(10)15-3/h5-8H,4H2,1-3H3/q+1