3-[(4-bromophenyl)amino]-2-(7H-purin-6-yl)propan-1-ol

Systemtic Name: 3-[(4-bromophenyl)amino]-2-(7H-purin-6-yl)propan-1-ol Openeye Name: 3-(4-bromoanilino)-2-(7H-purin-6-yl)propan-1-ol CAS Name: 3-(4-bromoanilino)-2-(7H-purin-6-yl)-1-propanol IUPAC Name: 3-(4-bromoanilino)-2-(7H-purin-6-yl)propan-1-ol Traditional Name: 3-(4-bromoanilino)-2-(7H-purin-6-yl)propan-1-ol Formula: C14H14BrN5O MolecularWeight: 348.19786

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NCC(CO)C2=C3C(=NC=N2)N=CN3)Br

Isomeric SMILES

C1=CC(=CC=C1NCC(CO)C2=C3C(=NC=N2)N=CN3)Br

InChI

InChI=1S/C14H14BrN5O/c15-10-1-3-11(4-2-10)16-5-9(6-21)12-13-14(19-7-17-12)20-8-18-13/h1-4,7-9,16,21H,5-6H2,(H,17,18,19,20)