[5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl-(3-azanylbutyl)-methyl-sulfanium

Systemtic Name: [5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl-(3-azanylbutyl)-methyl-sulfanium Openeye Name: 3-aminobutyl-[[5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl]-methyl-sulfonium CAS Name: 3-aminobutyl-[[5-(6-aminopurin-9-yl)-3,4-dihydroxy-2-oxolanyl]methyl]-methylsulfonium IUPAC Name: 3-aminobutyl-[[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl]-methylsulfanium Traditional Name: (5-adenin-9-yl-3,4-dihydroxy-tetrahydrofuran-2-yl)methyl-(3-aminobutyl)-methyl-sulfonium Formula: C15H25N6O3S+ MolecularWeight: 369.4624

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC[S+](C)CC1C(C(C(O1)N2C=NC3=C2N=CN=C3N)O)O)N

Isomeric SMILES

CC(CC[S+](C)CC1C(C(C(O1)N2C=NC3=C2N=CN=C3N)O)O)N

InChI

InChI=1S/C15H25N6O3S/c1-8(16)3-4-25(2)5-9-11(22)12(23)15(24-9)21-7-20-10-13(17)18-6-19-14(10)21/h6-9,11-12,15,22-23H,3-5,16H2,1-2H3,(H2,17,18,19)/q+1