2-azanyl-9-[(2R,4S,5R)-5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-8-thiophen-2-yl-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[(2R,4S,5R)-5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-8-thiophen-2-yl-3H-purin-6-one Openeye Name: 2-amino-9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-8-(2-thienyl)-3H-purin-6-one CAS Name: 2-amino-9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-8-thiophen-2-yl-3H-purin-6-one IUPAC Name: 2-amino-9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-8-thiophen-2-yl-3H-purin-6-one Traditional Name: 2-amino-9-[(2R,4S,5R)-4-hydroxy-5-methylol-tetrahydrofuran-2-yl]-8-(2-thienyl)-3H-purin-6-one Formula: C14H15N5O4S MolecularWeight: 349.365

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C3=C(C(=O)N=C(N3)N)N=C2C4=CC=CS4)CO)O

Isomeric SMILES

C1[C@@H]([C@H](O[C@H]1N2C3=C(C(=O)N=C(N3)N)N=C2C4=CC=CS4)CO)O

InChI

InChI=1S/C14H15N5O4S/c15-14-17-12-10(13(22)18-14)16-11(8-2-1-3-24-8)19(12)9-4-6(21)7(5-20)23-9/h1-3,6-7,9,20-21H,4-5H2,(H3,15,17,18,22)/t6-,7+,9+/m0/s1