1-[5-(6-aminopurin-9-yl)-2-(hydroxymethyl)-4-oxidanyl-oxolan-3-yl]thiourea

Systemtic Name: 1-[5-(6-aminopurin-9-yl)-2-(hydroxymethyl)-4-oxidanyl-oxolan-3-yl]thiourea Openeye Name: [5-(6-aminopurin-9-yl)-4-hydroxy-2-(hydroxymethyl)tetrahydrofuran-3-yl]thiourea CAS Name: [5-(6-aminopurin-9-yl)-4-hydroxy-2-(hydroxymethyl)-3-oxolanyl]thiourea IUPAC Name: [5-(6-aminopurin-9-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]thiourea Traditional Name: (5-adenin-9-yl-4-hydroxy-2-methylol-tetrahydrofuran-3-yl)thiourea Formula: C11H15N7O3S MolecularWeight: 325.3469

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(C(=N1)N)N=CN2C3C(C(C(O3)CO)NC(=S)N)O

Isomeric SMILES

C1=NC2=C(C(=N1)N)N=CN2C3C(C(C(O3)CO)NC(=S)N)O

InChI

InChI=1S/C11H15N7O3S/c12-8-6-9(15-2-14-8)18(3-16-6)10-7(20)5(17-11(13)22)4(1-19)21-10/h2-5,7,10,19-20H,1H2,(H2,12,14,15)(H3,13,17,22)