6-azanyl-3-[(2R)-2,3-bis(oxidanyl)propyl]-7,9-dihydropurin-3-ium-8-thione

Systemtic Name: 6-azanyl-3-[(2R)-2,3-bis(oxidanyl)propyl]-7,9-dihydropurin-3-ium-8-thione Openeye Name: 6-amino-3-[(2R)-2,3-dihydroxypropyl]-7,9-dihydropurin-3-ium-8-thione CAS Name: 6-amino-3-[(2R)-2,3-dihydroxypropyl]-7,9-dihydropurin-3-ium-8-thione IUPAC Name: 6-amino-3-[(2R)-2,3-dihydroxypropyl]-7,9-dihydropurin-3-ium-8-thione Traditional Name: 6-amino-3-[(2R)-2,3-dihydroxypropyl]-7,9-dihydropurin-3-ium-8-thione Formula: C8H12N5O2S+ MolecularWeight: 242.27818

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC(=C2C(=[N+]1CC(CO)O)NC(=S)N2)N

Isomeric SMILES

C1=NC(=C2C(=[N+]1C[C@H](CO)O)NC(=S)N2)N

InChI

InChI=1S/C8H11N5O2S/c9-6-5-7(12-8(16)11-5)13(3-10-6)1-4(15)2-14/h3-4,14-15H,1-2H2,(H3,9,11,12,16)/p+1/t4-/m1/s1