7-[[4-oxidanylbutyl-(phenylmethyl)amino]methyl]-1,5-dihydropyrrolo[3,2-d]pyrimidin-4-one

Systemtic Name: 7-[[4-oxidanylbutyl-(phenylmethyl)amino]methyl]-1,5-dihydropyrrolo[3,2-d]pyrimidin-4-one Openeye Name: 7-[[benzyl(4-hydroxybutyl)amino]methyl]-1,5-dihydropyrrolo[3,2-d]pyrimidin-4-one CAS Name: 7-[[4-hydroxybutyl-(phenylmethyl)amino]methyl]-1,5-dihydropyrrolo[3,2-d]pyrimidin-4-one IUPAC Name: 7-[[benzyl(4-hydroxybutyl)amino]methyl]-1,5-dihydropyrrolo[3,2-d]pyrimidin-4-one Traditional Name: 7-[[benzyl(4-hydroxybutyl)amino]methyl]-1,5-dihydropyrrolo[3,2-d]pyrimidin-4-one Formula: C18H22N4O2 MolecularWeight: 326.39288

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CCCCO)CC2=CNC3=C2NC=NC3=O

Isomeric SMILES

C1=CC=C(C=C1)CN(CCCCO)CC2=CNC3=C2NC=NC3=O

InChI

InChI=1S/C18H22N4O2/c23-9-5-4-8-22(11-14-6-2-1-3-7-14)12-15-10-19-17-16(15)20-13-21-18(17)24/h1-3,6-7,10,13,19,23H,4-5,8-9,11-12H2,(H,20,21,24)