2-[[6-[(4-bromophenyl)methylamino]-9-propan-2-yl-purin-2-yl]amino]ethanol

Systemtic Name: 2-[[6-[(4-bromophenyl)methylamino]-9-propan-2-yl-purin-2-yl]amino]ethanol Openeye Name: 2-[[6-[(4-bromophenyl)methylamino]-9-isopropyl-purin-2-yl]amino]ethanol CAS Name: 2-[[6-[(4-bromophenyl)methylamino]-9-propan-2-yl-2-purinyl]amino]ethanol IUPAC Name: 2-[[6-[(4-bromophenyl)methylamino]-9-propan-2-ylpurin-2-yl]amino]ethanol Traditional Name: 2-[[6-[(4-bromobenzyl)amino]-9-isopropyl-purin-2-yl]amino]ethanol Formula: C17H21BrN6O MolecularWeight: 405.29224

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC=C(C=C3)Br)NCCO

Isomeric SMILES

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC=C(C=C3)Br)NCCO

InChI

InChI=1S/C17H21BrN6O/c1-11(2)24-10-21-14-15(20-9-12-3-5-13(18)6-4-12)22-17(19-7-8-25)23-16(14)24/h3-6,10-11,25H,7-9H2,1-2H3,(H2,19,20,22,23)