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2-[(3,4-dimethylphenyl)methylamino]-7-(4-methoxybutyl)-3H-purin-6-one
2-[(3,4-dimethylphenyl)methylamino]-7-(4-methoxybutyl)-3H-purin-6-one
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Descriptors Computed from Structure
Canonical SMILES:
CC1=C(C=C(C=C1)CNC2=NC(=O)C3=C(N2)N=CN3CCCCOC)C
Isomeric SMILES
CC1=C(C=C(C=C1)CNC2=NC(=O)C3=C(N2)N=CN3CCCCOC)C
InChI
InChI=1S/C19H25N5O2/c1-13-6-7-15(10-14(13)2)11-20-19-22-17-16(18(25)23-19)24(12-21-17)8-4-5-9-26-3/h6-7,10,12H,4-5,8-9,11H2,1-3H3,(H2,20,22,23,25)
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