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

Systemtic Name: 2-[[6-[(4-ethylphenyl)amino]-9-methyl-purin-2-yl]amino]ethanol Openeye Name: 2-[[6-(4-ethylanilino)-9-methyl-purin-2-yl]amino]ethanol CAS Name: 2-[[6-(4-ethylanilino)-9-methyl-2-purinyl]amino]ethanol IUPAC Name: 2-[[6-(4-ethylanilino)-9-methylpurin-2-yl]amino]ethanol Traditional Name: 2-[[6-(4-ethylanilino)-9-methyl-purin-2-yl]amino]ethanol Formula: C16H20N6O MolecularWeight: 312.3696

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC2=NC(=NC3=C2N=CN3C)NCCO

Isomeric SMILES

CCC1=CC=C(C=C1)NC2=NC(=NC3=C2N=CN3C)NCCO

InChI

InChI=1S/C16H20N6O/c1-3-11-4-6-12(7-5-11)19-14-13-15(22(2)10-18-13)21-16(20-14)17-8-9-23/h4-7,10,23H,3,8-9H2,1-2H3,(H2,17,19,20,21)