8-(6-chloranylpyridin-3-yl)-7-methyl-1,3-dipropyl-4,5-dihydropurine-2,6-dione

Systemtic Name: 8-(6-chloranylpyridin-3-yl)-7-methyl-1,3-dipropyl-4,5-dihydropurine-2,6-dione Openeye Name: 8-(6-chloro-3-pyridyl)-7-methyl-1,3-dipropyl-4,5-dihydropurine-2,6-dione CAS Name: 8-(6-chloro-3-pyridinyl)-7-methyl-1,3-dipropyl-4,5-dihydropurine-2,6-dione IUPAC Name: 8-(6-chloropyridin-3-yl)-7-methyl-1,3-dipropyl-4,5-dihydropurine-2,6-dione Traditional Name: 8-(6-chloro-3-pyridyl)-7-methyl-1,3-dipropyl-4,5-dihydropurine-2,6-quinone Formula: C17H22ClN5O2 MolecularWeight: 363.84188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2C(C(=O)N(C1=O)CCC)N(C(=N2)C3=CN=C(C=C3)Cl)C

Isomeric SMILES

CCCN1C2C(C(=O)N(C1=O)CCC)N(C(=N2)C3=CN=C(C=C3)Cl)C

InChI

InChI=1S/C17H22ClN5O2/c1-4-8-22-15-13(16(24)23(9-5-2)17(22)25)21(3)14(20-15)11-6-7-12(18)19-10-11/h6-7,10,13,15H,4-5,8-9H2,1-3H3