2-[(1-propan-2-yl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 2-[(1-propan-2-yl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 2-[(1-isopropyltetrazol-5-yl)sulfanylmethyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 2-[[(1-propan-2-yl-5-tetrazolyl)thio]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 2-[(1-propan-2-yltetrazol-5-yl)sulfanylmethyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 2-[[(1-isopropyltetrazol-5-yl)thio]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C13H15N6OS+ MolecularWeight: 303.3628

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=NN=N1)SCC2=CC(=O)[N+]3=CC=CC=C3N2

Isomeric SMILES

CC(C)N1C(=NN=N1)SCC2=CC(=O)[N+]3=CC=CC=C3N2

InChI

InChI=1S/C13H14N6OS/c1-9(2)19-13(15-16-17-19)21-8-10-7-12(20)18-6-4-3-5-11(18)14-10/h3-7,9H,8H2,1-2H3/p+1