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

Systemtic Name: 2-azanyl-7-[1-[(1-methylsulfanyl-3-oxidanyl-propan-2-yl)amino]-2-oxidanyl-ethyl]-1,5-dihydropyrrolo[3,2-d]pyrimidin-4-one Openeye Name: 2-amino-7-[2-hydroxy-1-[[1-(hydroxymethyl)-2-methylsulfanyl-ethyl]amino]ethyl]-1,5-dihydropyrrolo[3,2-d]pyrimidin-4-one CAS Name: 2-amino-7-[2-hydroxy-1-[[1-hydroxy-3-(methylthio)propan-2-yl]amino]ethyl]-1,5-dihydropyrrolo[3,2-d]pyrimidin-4-one IUPAC Name: 2-amino-7-[2-hydroxy-1-[(1-hydroxy-3-methylsulfanylpropan-2-yl)amino]ethyl]-1,5-dihydropyrrolo[3,2-d]pyrimidin-4-one Traditional Name: 2-amino-7-[2-hydroxy-1-[[1-methylol-2-(methylthio)ethyl]amino]ethyl]-1,5-dihydropyrrolo[3,2-d]pyrimidin-4-one Formula: C12H19N5O3S MolecularWeight: 313.37596

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Descriptors Computed from Structure

Canonical SMILES:

CSCC(CO)NC(CO)C1=CNC2=C1NC(=NC2=O)N

Isomeric SMILES

CSCC(CO)NC(CO)C1=CNC2=C1NC(=NC2=O)N

InChI

InChI=1S/C12H19N5O3S/c1-21-5-6(3-18)15-8(4-19)7-2-14-10-9(7)16-12(13)17-11(10)20/h2,6,8,14-15,18-19H,3-5H2,1H3,(H3,13,16,17,20)