8-(2-azanylpyrimidin-4-yl)-N-(3,5-dimethylphenyl)-9-ethyl-purin-2-amine

Systemtic Name: 8-(2-azanylpyrimidin-4-yl)-N-(3,5-dimethylphenyl)-9-ethyl-purin-2-amine Openeye Name: 8-(2-aminopyrimidin-4-yl)-N-(3,5-dimethylphenyl)-9-ethyl-purin-2-amine CAS Name: 8-(2-amino-4-pyrimidinyl)-N-(3,5-dimethylphenyl)-9-ethyl-2-purinamine IUPAC Name: 8-(2-aminopyrimidin-4-yl)-N-(3,5-dimethylphenyl)-9-ethylpurin-2-amine Traditional Name: [8-(2-aminopyrimidin-4-yl)-9-ethyl-purin-2-yl]-(3,5-dimethylphenyl)amine Formula: C19H20N8 MolecularWeight: 360.4157

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NC2=CN=C(N=C21)NC3=CC(=CC(=C3)C)C)C4=NC(=NC=C4)N

Isomeric SMILES

CCN1C(=NC2=CN=C(N=C21)NC3=CC(=CC(=C3)C)C)C4=NC(=NC=C4)N

InChI

InChI=1S/C19H20N8/c1-4-27-16(14-5-6-21-18(20)25-14)24-15-10-22-19(26-17(15)27)23-13-8-11(2)7-12(3)9-13/h5-10H,4H2,1-3H3,(H2,20,21,25)(H,22,23,26)