6,8-dimethyl-7-nonyl-1H-pyrimido[1,2-a][1,3,5]triazin-5-ium-2-thione

Systemtic Name: 6,8-dimethyl-7-nonyl-1H-pyrimido[1,2-a][1,3,5]triazin-5-ium-2-thione Openeye Name: 6,8-dimethyl-7-nonyl-1H-pyrimido[1,2-a][1,3,5]triazin-5-ium-2-thione CAS Name: 6,8-dimethyl-7-nonyl-1H-pyrimido[1,2-a][1,3,5]triazin-5-ium-2-thione IUPAC Name: 6,8-dimethyl-7-nonyl-1H-pyrimido[1,2-a][1,3,5]triazin-5-ium-2-thione Traditional Name: 6,8-dimethyl-7-nonyl-1H-pyrimido[1,2-a][1,3,5]triazin-5-ium-2-thione Formula: C17H27N4S+ MolecularWeight: 319.48808

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=C(N=C2NC(=S)N=C[N+]2=C1C)C

Isomeric SMILES

CCCCCCCCCC1=C(N=C2NC(=S)N=C[N+]2=C1C)C

InChI

InChI=1S/C17H26N4S/c1-4-5-6-7-8-9-10-11-15-13(2)19-16-20-17(22)18-12-21(16)14(15)3/h12H,4-11H2,1-3H3/p+1