1-[(2R,4S,5S)-4-[(5-azanyl-1H-1,2,4-triazol-3-yl)amino]-5-(hydroxymethyl)oxolan-2-yl]-5-methyl-pyrimidine-2,4-dione

Systemtic Name: 1-[(2R,4S,5S)-4-[(5-azanyl-1H-1,2,4-triazol-3-yl)amino]-5-(hydroxymethyl)oxolan-2-yl]-5-methyl-pyrimidine-2,4-dione Openeye Name: 1-[(2R,4S,5S)-4-[(5-amino-1H-1,2,4-triazol-3-yl)amino]-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-dione CAS Name: 1-[(2R,4S,5S)-4-[(5-amino-1H-1,2,4-triazol-3-yl)amino]-5-(hydroxymethyl)-2-oxolanyl]-5-methylpyrimidine-2,4-dione IUPAC Name: 1-[(2R,4S,5S)-4-[(5-amino-1H-1,2,4-triazol-3-yl)amino]-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione Traditional Name: 1-[(2R,4S,5S)-4-[(5-amino-1H-1,2,4-triazol-3-yl)amino]-5-methylol-tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-quinone Formula: C12H17N7O4 MolecularWeight: 323.30788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)NC1=O)C2CC(C(O2)CO)NC3=NNC(=N3)N

Isomeric SMILES

CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)CO)NC3=NNC(=N3)N

InChI

InChI=1S/C12H17N7O4/c1-5-3-19(12(22)15-9(5)21)8-2-6(7(4-20)23-8)14-11-16-10(13)17-18-11/h3,6-8,20H,2,4H2,1H3,(H,15,21,22)(H4,13,14,16,17,18)/t6-,7+,8+/m0/s1