2-azanyl-9-[5-(ethylsulfanylmethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-3H-purine-6-thione

Systemtic Name: 2-azanyl-9-[5-(ethylsulfanylmethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-3H-purine-6-thione Openeye Name: 2-amino-9-[5-(ethylsulfanylmethyl)-3,4-dihydroxy-tetrahydrofuran-2-yl]-3H-purine-6-thione CAS Name: 2-amino-9-[5-[(ethylthio)methyl]-3,4-dihydroxy-2-oxolanyl]-3H-purine-6-thione IUPAC Name: 2-amino-9-[5-(ethylsulfanylmethyl)-3,4-dihydroxyoxolan-2-yl]-3H-purine-6-thione Traditional Name: 2-amino-9-[5-[(ethylthio)methyl]-3,4-dihydroxy-tetrahydrofuran-2-yl]-3H-purine-6-thione Formula: C12H17N5O3S2 MolecularWeight: 343.42508

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Descriptors Computed from Structure

Canonical SMILES:

CCSCC1C(C(C(O1)N2C=NC3=C2NC(=NC3=S)N)O)O

Isomeric SMILES

CCSCC1C(C(C(O1)N2C=NC3=C2NC(=NC3=S)N)O)O

InChI

InChI=1S/C12H17N5O3S2/c1-2-22-3-5-7(18)8(19)11(20-5)17-4-14-6-9(17)15-12(13)16-10(6)21/h4-5,7-8,11,18-19H,2-3H2,1H3,(H3,13,15,16,21)