2-azanyl-7-[[methyl-(4-methylsulfanyl-2-oxidanyl-butyl)amino]methyl]-1,5-dihydropyrrolo[3,2-d]pyrimidin-4-one

Systemtic Name: 2-azanyl-7-[[methyl-(4-methylsulfanyl-2-oxidanyl-butyl)amino]methyl]-1,5-dihydropyrrolo[3,2-d]pyrimidin-4-one Openeye Name: 2-amino-7-[[(2-hydroxy-4-methylsulfanyl-butyl)-methyl-amino]methyl]-1,5-dihydropyrrolo[3,2-d]pyrimidin-4-one CAS Name: 2-amino-7-[[[2-hydroxy-4-(methylthio)butyl]-methylamino]methyl]-1,5-dihydropyrrolo[3,2-d]pyrimidin-4-one IUPAC Name: 2-amino-7-[[(2-hydroxy-4-methylsulfanylbutyl)-methylamino]methyl]-1,5-dihydropyrrolo[3,2-d]pyrimidin-4-one Traditional Name: 2-amino-7-[[[2-hydroxy-4-(methylthio)butyl]-methyl-amino]methyl]-1,5-dihydropyrrolo[3,2-d]pyrimidin-4-one Formula: C13H21N5O2S MolecularWeight: 311.40314

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CNC2=C1NC(=NC2=O)N)CC(CCSC)O

Isomeric SMILES

CN(CC1=CNC2=C1NC(=NC2=O)N)CC(CCSC)O

InChI

InChI=1S/C13H21N5O2S/c1-18(7-9(19)3-4-21-2)6-8-5-15-11-10(8)16-13(14)17-12(11)20/h5,9,15,19H,3-4,6-7H2,1-2H3,(H3,14,16,17,20)