2,4-dimethyl-8-(piperazin-4-ium-1-ylmethyl)purino[8,7-b][1,3]thiazole-1,3-dione

Systemtic Name: 2,4-dimethyl-8-(piperazin-4-ium-1-ylmethyl)purino[8,7-b][1,3]thiazole-1,3-dione Openeye Name: 2,4-dimethyl-8-(piperazin-4-ium-1-ylmethyl)purino[8,7-b]thiazole-1,3-dione CAS Name: 2,4-dimethyl-8-(1-piperazin-4-iumylmethyl)purino[8,7-b]thiazole-1,3-dione IUPAC Name: 2,4-dimethyl-8-(piperazin-4-ium-1-ylmethyl)purino[8,7-b][1,3]thiazole-1,3-dione Traditional Name: 2,4-dimethyl-8-(piperazin-4-ium-1-ylmethyl)purino[8,7-b]thiazole-1,3-quinone Formula: C14H19N6O2S+ MolecularWeight: 335.40466

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N3C(=CSC3=N2)CN4CC[NH2+]CC4

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N3C(=CSC3=N2)CN4CC[NH2+]CC4

InChI

InChI=1S/C14H18N6O2S/c1-17-11-10(12(21)18(2)14(17)22)20-9(8-23-13(20)16-11)7-19-5-3-15-4-6-19/h8,15H,3-7H2,1-2H3/p+1