trimethyl-[(2-methylsulfanyl-4-oxidanylidene-1,7-dihydropyrrolo[2,3-d]pyrimidin-5-yl)methyl]azanium

Systemtic Name: trimethyl-[(2-methylsulfanyl-4-oxidanylidene-1,7-dihydropyrrolo[2,3-d]pyrimidin-5-yl)methyl]azanium Openeye Name: trimethyl-[(2-methylsulfanyl-4-oxo-1,7-dihydropyrrolo[2,3-d]pyrimidin-5-yl)methyl]ammonium CAS Name: trimethyl-[[2-(methylthio)-4-oxo-1,7-dihydropyrrolo[2,3-d]pyrimidin-5-yl]methyl]ammonium IUPAC Name: trimethyl-[(2-methylsulfanyl-4-oxo-1,7-dihydropyrrolo[2,3-d]pyrimidin-5-yl)methyl]azanium Traditional Name: [4-keto-2-(methylthio)-1,7-dihydropyrrolo[2,3-d]pyrimidin-5-yl]methyl-trimethyl-ammonium Formula: C11H17N4OS+ MolecularWeight: 253.34388

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CC1=CNC2=C1C(=O)N=C(N2)SC

Isomeric SMILES

C[N+](C)(C)CC1=CNC2=C1C(=O)N=C(N2)SC

InChI

InChI=1S/C11H16N4OS/c1-15(2,3)6-7-5-12-9-8(7)10(16)14-11(13-9)17-4/h5H,6H2,1-4H3,(H-,12,13,14,16)/p+1