8-chloranyl-7-[2-(2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 8-chloranyl-7-[2-(2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]-1,3-dimethyl-purine-2,6-dione Openeye Name: 8-chloro-7-(2-indolin-1-yl-2-oxo-ethyl)-1,3-dimethyl-purine-2,6-dione CAS Name: 8-chloro-7-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-1,3-dimethylpurine-2,6-dione IUPAC Name: 8-chloro-7-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-1,3-dimethylpurine-2,6-dione Traditional Name: 8-chloro-7-(2-indolin-1-yl-2-keto-ethyl)-1,3-dimethyl-xanthine Formula: C17H16ClN5O3 MolecularWeight: 373.79364

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)Cl)CC(=O)N3CCC4=CC=CC=C43

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)Cl)CC(=O)N3CCC4=CC=CC=C43

InChI

InChI=1S/C17H16ClN5O3/c1-20-14-13(15(25)21(2)17(20)26)23(16(18)19-14)9-12(24)22-8-7-10-5-3-4-6-11(10)22/h3-6H,7-9H2,1-2H3