1,3-dimethyl-8-[2-(2-oxidanylideneindol-3-yl)hydrazinyl]-7-[(2R)-2-oxidanyl-3-phenoxy-propyl]purine-2,6-dione

Systemtic Name: 1,3-dimethyl-8-[2-(2-oxidanylideneindol-3-yl)hydrazinyl]-7-[(2R)-2-oxidanyl-3-phenoxy-propyl]purine-2,6-dione Openeye Name: 7-[(2R)-2-hydroxy-3-phenoxy-propyl]-1,3-dimethyl-8-[2-(2-oxoindol-3-yl)hydrazino]purine-2,6-dione CAS Name: 7-[(2R)-2-hydroxy-3-phenoxypropyl]-1,3-dimethyl-8-[(2-oxo-3-indolyl)hydrazo]purine-2,6-dione IUPAC Name: 7-[(2R)-2-hydroxy-3-phenoxypropyl]-1,3-dimethyl-8-[2-(2-oxoindol-3-yl)hydrazinyl]purine-2,6-dione Traditional Name: 7-[(2R)-2-hydroxy-3-phenoxy-propyl]-8-[N'-(2-ketoindol-3-yl)hydrazino]-1,3-dimethyl-xanthine Formula: C24H23N7O5 MolecularWeight: 489.48332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NNC3=C4C=CC=CC4=NC3=O)CC(COC5=CC=CC=C5)O

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NNC3=C4C=CC=CC4=NC3=O)C[C@H](COC5=CC=CC=C5)O

InChI

InChI=1S/C24H23N7O5/c1-29-20-19(22(34)30(2)24(29)35)31(12-14(32)13-36-15-8-4-3-5-9-15)23(26-20)28-27-18-16-10-6-7-11-17(16)25-21(18)33/h3-11,14,32H,12-13H2,1-2H3,(H,26,28)(H,25,27,33)/t14-/m1/s1