2-(4-methylpiperazin-4-ium-1-yl)-8H-pyrimido[4,5-d]pyrimidine-5,7-dithione

Systemtic Name: 2-(4-methylpiperazin-4-ium-1-yl)-8H-pyrimido[4,5-d]pyrimidine-5,7-dithione Openeye Name: 2-(4-methylpiperazin-4-ium-1-yl)-8H-pyrimido[4,5-d]pyrimidine-5,7-dithione CAS Name: 2-(4-methyl-1-piperazin-4-iumyl)-8H-pyrimido[4,5-d]pyrimidine-5,7-dithione IUPAC Name: 2-(4-methylpiperazin-4-ium-1-yl)-8H-pyrimido[4,5-d]pyrimidine-5,7-dithione Traditional Name: 2-(4-methylpiperazin-4-ium-1-yl)-8H-pyrimido[4,5-d]pyrimidine-5,7-dithione Formula: C11H15N6S2+ MolecularWeight: 295.407

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=NC=C3C(=N2)NC(=S)NC3=S

Isomeric SMILES

C[NH+]1CCN(CC1)C2=NC=C3C(=N2)NC(=S)NC3=S

InChI

InChI=1S/C11H14N6S2/c1-16-2-4-17(5-3-16)10-12-6-7-8(13-10)14-11(19)15-9(7)18/h6H,2-5H2,1H3,(H2,12,13,14,15,18,19)/p+1