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

Systemtic Name: 7-(2-bromoethyl)-8-(6-chloranylpyridin-3-yl)-1,3-dipropyl-4,5-dihydropurine-2,6-dione Openeye Name: 7-(2-bromoethyl)-8-(6-chloro-3-pyridyl)-1,3-dipropyl-4,5-dihydropurine-2,6-dione CAS Name: 7-(2-bromoethyl)-8-(6-chloro-3-pyridinyl)-1,3-dipropyl-4,5-dihydropurine-2,6-dione IUPAC Name: 7-(2-bromoethyl)-8-(6-chloropyridin-3-yl)-1,3-dipropyl-4,5-dihydropurine-2,6-dione Traditional Name: 7-(2-bromoethyl)-8-(6-chloro-3-pyridyl)-1,3-dipropyl-4,5-dihydropurine-2,6-quinone Formula: C18H23BrClN5O2 MolecularWeight: 456.76452

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23BrClN5O2/c1-3-8-24-16-14(17(26)25(9-4-2)18(24)27)23(10-7-19)15(22-16)12-5-6-13(20)21-11-12/h5-6,11,14,16H,3-4,7-10H2,1-2H3