7-[(2S)-2,3-bis(oxidanyl)propyl]-3-methyl-8-(propan-2-ylamino)purine-2,6-dione

Systemtic Name: 7-[(2S)-2,3-bis(oxidanyl)propyl]-3-methyl-8-(propan-2-ylamino)purine-2,6-dione Openeye Name: 7-[(2S)-2,3-dihydroxypropyl]-8-(isopropylamino)-3-methyl-purine-2,6-dione CAS Name: 7-[(2S)-2,3-dihydroxypropyl]-3-methyl-8-(propan-2-ylamino)purine-2,6-dione IUPAC Name: 7-[(2S)-2,3-dihydroxypropyl]-3-methyl-8-(propan-2-ylamino)purine-2,6-dione Traditional Name: 7-[(2S)-2,3-dihydroxypropyl]-8-(isopropylamino)-3-methyl-xanthine Formula: C12H19N5O4 MolecularWeight: 297.31036

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=NC2=C(N1CC(CO)O)C(=O)NC(=O)N2C

Isomeric SMILES

CC(C)NC1=NC2=C(N1C[C@@H](CO)O)C(=O)NC(=O)N2C

InChI

InChI=1S/C12H19N5O4/c1-6(2)13-11-14-9-8(17(11)4-7(19)5-18)10(20)15-12(21)16(9)3/h6-7,18-19H,4-5H2,1-3H3,(H,13,14)(H,15,20,21)/t7-/m0/s1