2-azanyl-9-[2,3-bis(oxidanyl)propoxymethyl]-6-ethyl-7H-purine-8-thione

Systemtic Name: 2-azanyl-9-[2,3-bis(oxidanyl)propoxymethyl]-6-ethyl-7H-purine-8-thione Openeye Name: 2-amino-9-(2,3-dihydroxypropoxymethyl)-6-ethyl-7H-purine-8-thione CAS Name: 2-amino-9-(2,3-dihydroxypropoxymethyl)-6-ethyl-7H-purine-8-thione IUPAC Name: 2-amino-9-(2,3-dihydroxypropoxymethyl)-6-ethyl-7H-purine-8-thione Traditional Name: 2-amino-6-ethyl-9-(glyceryloxymethyl)-7H-purine-8-thione Formula: C11H17N5O3S MolecularWeight: 299.34938

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=NC(=N1)N)N(C(=S)N2)COCC(CO)O

Isomeric SMILES

CCC1=C2C(=NC(=N1)N)N(C(=S)N2)COCC(CO)O

InChI

InChI=1S/C11H17N5O3S/c1-2-7-8-9(15-10(12)13-7)16(11(20)14-8)5-19-4-6(18)3-17/h6,17-18H,2-5H2,1H3,(H,14,20)(H2,12,13,15)