2-azanyl-9-[3,4-bis(oxidanyl)-5-(thiophen-2-ylmethoxymethyl)oxolan-2-yl]-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[3,4-bis(oxidanyl)-5-(thiophen-2-ylmethoxymethyl)oxolan-2-yl]-3H-purin-6-one Openeye Name: 2-amino-9-[3,4-dihydroxy-5-(2-thienylmethoxymethyl)tetrahydrofuran-2-yl]-3H-purin-6-one CAS Name: 2-amino-9-[3,4-dihydroxy-5-(thiophen-2-ylmethoxymethyl)-2-oxolanyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[3,4-dihydroxy-5-(thiophen-2-ylmethoxymethyl)oxolan-2-yl]-3H-purin-6-one Traditional Name: 2-amino-9-[3,4-dihydroxy-5-(2-thenyloxymethyl)tetrahydrofuran-2-yl]-3H-purin-6-one Formula: C15H17N5O5S MolecularWeight: 379.39098

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)COCC2C(C(C(O2)N3C=NC4=C3NC(=NC4=O)N)O)O

Isomeric SMILES

C1=CSC(=C1)COCC2C(C(C(O2)N3C=NC4=C3NC(=NC4=O)N)O)O

InChI

InChI=1S/C15H17N5O5S/c16-15-18-12-9(13(23)19-15)17-6-20(12)14-11(22)10(21)8(25-14)5-24-4-7-2-1-3-26-7/h1-3,6,8,10-11,14,21-22H,4-5H2,(H3,16,18,19,23)