2-[[6-[(2-methylphenyl)amino]-9-propan-2-yl-purin-2-yl]amino]ethanol

Systemtic Name: 2-[[6-[(2-methylphenyl)amino]-9-propan-2-yl-purin-2-yl]amino]ethanol Openeye Name: 2-[[9-isopropyl-6-(2-methylanilino)purin-2-yl]amino]ethanol CAS Name: 2-[[6-(2-methylanilino)-9-propan-2-yl-2-purinyl]amino]ethanol IUPAC Name: 2-[[6-(2-methylanilino)-9-propan-2-ylpurin-2-yl]amino]ethanol Traditional Name: 2-[[9-isopropyl-6-(o-toluidino)purin-2-yl]amino]ethanol Formula: C17H22N6O MolecularWeight: 326.39618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=NC(=NC3=C2N=CN3C(C)C)NCCO

Isomeric SMILES

CC1=CC=CC=C1NC2=NC(=NC3=C2N=CN3C(C)C)NCCO

InChI

InChI=1S/C17H22N6O/c1-11(2)23-10-19-14-15(20-13-7-5-4-6-12(13)3)21-17(18-8-9-24)22-16(14)23/h4-7,10-11,24H,8-9H2,1-3H3,(H2,18,20,21,22)