3-[6-azanyl-8-bromanyl-9-(phenylmethyl)purin-2-yl]oxypropan-1-ol

Systemtic Name: 3-[6-azanyl-8-bromanyl-9-(phenylmethyl)purin-2-yl]oxypropan-1-ol Openeye Name: 3-(6-amino-9-benzyl-8-bromo-purin-2-yl)oxypropan-1-ol CAS Name: 3-[[6-amino-8-bromo-9-(phenylmethyl)-2-purinyl]oxy]-1-propanol IUPAC Name: 3-(6-amino-9-benzyl-8-bromopurin-2-yl)oxypropan-1-ol Traditional Name: 3-(6-amino-9-benzyl-8-bromo-purin-2-yl)oxypropan-1-ol Formula: C15H16BrN5O2 MolecularWeight: 378.22384

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=C(C(=NC(=N3)OCCCO)N)N=C2Br

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=C(C(=NC(=N3)OCCCO)N)N=C2Br

InChI

InChI=1S/C15H16BrN5O2/c16-14-18-11-12(17)19-15(23-8-4-7-22)20-13(11)21(14)9-10-5-2-1-3-6-10/h1-3,5-6,22H,4,7-9H2,(H2,17,19,20)