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7,8-diethyl-1,3-dimethyl-purine-2,6-dione; N-methylmethanamine

7,8-diethyl-1,3-dimethyl-purine-2,6-dione; N-methylmethanamine

Systemtic Name:7,8-diethyl-1,3-dimethyl-purine-2,6-dione; N-methylmethanamine
Openeye Name:7,8-diethyl-1,3-dimethyl-purine-2,6-dione; N-methylmethanamine
CAS Name:7,8-diethyl-1,3-dimethylpurine-2,6-dione; N-methylmethanamine
IUPAC Name:7,8-diethyl-1,3-dimethylpurine-2,6-dione; N-methylmethanamine
Traditional Name:7,8-diethyl-1,3-dimethyl-xanthine; dimethylamine
Formula: C13H23N5O2
MolecularWeight: 281.35402
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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(N1CC)C(=O)N(C(=O)N2C)C.CNC


Isomeric SMILES

CCC1=NC2=C(N1CC)C(=O)N(C(=O)N2C)C.CNC


InChI

InChI=1S/C11H16N4O2.C2H7N/c1-5-7-12-9-8(15(7)6-2)10(16)14(4)11(17)13(9)3;1-3-2/h5-6H2,1-4H3;3H,1-2H3


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