2-[[6-[(3-chlorophenyl)amino]-8-methyl-9-propan-2-yl-purin-2-yl]amino]ethanol

Systemtic Name: 2-[[6-[(3-chlorophenyl)amino]-8-methyl-9-propan-2-yl-purin-2-yl]amino]ethanol Openeye Name: 2-[[6-(3-chloroanilino)-9-isopropyl-8-methyl-purin-2-yl]amino]ethanol CAS Name: 2-[[6-(3-chloroanilino)-8-methyl-9-propan-2-yl-2-purinyl]amino]ethanol IUPAC Name: 2-[[6-(3-chloroanilino)-8-methyl-9-propan-2-ylpurin-2-yl]amino]ethanol Traditional Name: 2-[[6-(3-chloroanilino)-9-isopropyl-8-methyl-purin-2-yl]amino]ethanol Formula: C17H21ClN6O MolecularWeight: 360.84124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1C(C)C)N=C(N=C2NC3=CC(=CC=C3)Cl)NCCO

Isomeric SMILES

CC1=NC2=C(N1C(C)C)N=C(N=C2NC3=CC(=CC=C3)Cl)NCCO

InChI

InChI=1S/C17H21ClN6O/c1-10(2)24-11(3)20-14-15(21-13-6-4-5-12(18)9-13)22-17(19-7-8-25)23-16(14)24/h4-6,9-10,25H,7-8H2,1-3H3,(H2,19,21,22,23)