azanylidene-[4-[ethanoyl-(6-methylsulfanylpurin-9-yl)amino]butylimino]azanium

Systemtic Name: azanylidene-[4-[ethanoyl-(6-methylsulfanylpurin-9-yl)amino]butylimino]azanium Openeye Name: 4-[acetyl-(6-methylsulfanylpurin-9-yl)amino]butylimino-imino-ammonium CAS Name: 4-[acetyl-[6-(methylthio)-9-purinyl]amino]butylimino-iminoammonium IUPAC Name: 4-[acetyl-(6-methylsulfanylpurin-9-yl)amino]butylimino-iminoazanium Traditional Name: 4-[acetyl-[6-(methylthio)purin-9-yl]amino]butylimino-imino-ammonium Formula: C12H17N8OS+ MolecularWeight: 321.38138

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(CCCCN=[N+]=N)N1C=NC2=C1N=CN=C2SC

Isomeric SMILES

CC(=O)N(CCCCN=[N+]=N)N1C=NC2=C1N=CN=C2SC

InChI

InChI=1S/C12H17N8OS/c1-9(21)19(6-4-3-5-17-18-13)20-8-16-10-11(20)14-7-15-12(10)22-2/h7-8,13H,3-6H2,1-2H3/q+1