3,7-dimethyl-6-methylsulfanyl-2,9-dihydropurin-7-ium-2-amine

Systemtic Name: 3,7-dimethyl-6-methylsulfanyl-2,9-dihydropurin-7-ium-2-amine Openeye Name: 3,7-dimethyl-6-methylsulfanyl-2,9-dihydropurin-7-ium-2-amine CAS Name: 3,7-dimethyl-6-(methylthio)-2,9-dihydropurin-7-ium-2-amine IUPAC Name: 3,7-dimethyl-6-methylsulfanyl-2,9-dihydropurin-7-ium-2-amine Traditional Name: [3,7-dimethyl-6-(methylthio)-2,9-dihydropurin-7-ium-2-yl]amine Formula: C8H14N5S+ MolecularWeight: 212.29526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(N=C(C2=C1NC=[N+]2C)SC)N

Isomeric SMILES

CN1C(N=C(C2=C1NC=[N+]2C)SC)N

InChI

InChI=1S/C8H13N5S/c1-12-4-10-6-5(12)7(14-3)11-8(9)13(6)2/h4,8H,9H2,1-3H3/p+1