N-(3-bromophenyl)-6-(cyclohexylmethoxy)-7H-purin-2-amine

Systemtic Name: N-(3-bromophenyl)-6-(cyclohexylmethoxy)-7H-purin-2-amine Openeye Name: N-(3-bromophenyl)-6-(cyclohexylmethoxy)-7H-purin-2-amine CAS Name: N-(3-bromophenyl)-6-(cyclohexylmethoxy)-7H-purin-2-amine IUPAC Name: N-(3-bromophenyl)-6-(cyclohexylmethoxy)-7H-purin-2-amine Traditional Name: (3-bromophenyl)-[6-(cyclohexylmethoxy)-7H-purin-2-yl]amine Formula: C18H20BrN5O MolecularWeight: 402.2883

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)COC2=NC(=NC3=C2NC=N3)NC4=CC(=CC=C4)Br

Isomeric SMILES

C1CCC(CC1)COC2=NC(=NC3=C2NC=N3)NC4=CC(=CC=C4)Br

InChI

InChI=1S/C18H20BrN5O/c19-13-7-4-8-14(9-13)22-18-23-16-15(20-11-21-16)17(24-18)25-10-12-5-2-1-3-6-12/h4,7-9,11-12H,1-3,5-6,10H2,(H2,20,21,22,23,24)