2-[[9-ethyl-6-[(4-ethylphenyl)amino]purin-2-yl]amino]ethanol

Systemtic Name: 2-[[9-ethyl-6-[(4-ethylphenyl)amino]purin-2-yl]amino]ethanol Openeye Name: 2-[[9-ethyl-6-(4-ethylanilino)purin-2-yl]amino]ethanol CAS Name: 2-[[9-ethyl-6-(4-ethylanilino)-2-purinyl]amino]ethanol IUPAC Name: 2-[[9-ethyl-6-(4-ethylanilino)purin-2-yl]amino]ethanol Traditional Name: 2-[[9-ethyl-6-(4-ethylanilino)purin-2-yl]amino]ethanol Formula: C17H22N6O MolecularWeight: 326.39618

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC2=NC(=NC3=C2N=CN3CC)NCCO

Isomeric SMILES

CCC1=CC=C(C=C1)NC2=NC(=NC3=C2N=CN3CC)NCCO

InChI

InChI=1S/C17H22N6O/c1-3-12-5-7-13(8-6-12)20-15-14-16(23(4-2)11-19-14)22-17(21-15)18-9-10-24/h5-8,11,24H,3-4,9-10H2,1-2H3,(H2,18,20,21,22)